Product
Supplier
Encyclopedia
Inquiry
Home > Encyclopedia > 3-Cyanopyridine

3-Cyanopyridine

3-Cyanopyridine structure

3-Cyanopyridine 

structure
  • CAS No:

    100-54-9

  • Formula:

    C6H4N2

  • Chemical Name:

    3-Cyanopyridine

  • Synonyms:

    3-Pyridinecarbonitrile;Nicotinonitrile;3-Cyanopyridine;Nicotinic acid nitrile;3-Pyridylcarbonitrile;3-Pyridinenitrile;3-Azabenzonitrile;3-Pyridyl cyanide;β-Cyanopyridine;NSC 17558

  • Categories:

    Agrochemicals  >  Pesticide Intermediates

Description

white to beige solid The cyanopyridines are as follows: 2-cyano-:A white to tan liquid or solid. Almond odor. Boilingpoint=2213℃ ; freezing/melting point=27℃ ; flashpoint=89℃ . 3-cyano-: a colorless liquid or gray crystal-line solid.ChEBI: A nitrile that is pyridine substituted by a cyano group at position 3.


OtherSolid


3-pyridinecarbonitrile is a nitrile that is pyridine substituted by a cyano group at position 3. It is a nitrile and a member of pyridines. It derives from a pyridine.

3-Cyanopyridine Basic Attributes

104.11

104.11

107711

202-863-0

X64V0K6260

17558

DTXSID1026665

NEEDLES FROM PETROLEUM ETHER|Colorless liquid

29333999

Characteristics

36.7

0.2

Colorless or white to yellow Crystalline Mass, Crystals or Chunks

1.1590 g/cm3 @ Temp: 25 °C

51 °C

206.9 °C

184 °F

1.5242 (estimate)

H2O: 140 g/L (20 ºC)

Store below +30°C.

0.296 mm Hg @ 25 deg C

2.74e-07 atm-m3/mole|Henry's Law constant = 2.74X10-7 atm-cu m/mole @ 25 °C

pKa = 1.39 at 24 °C (conjugate acid)

Safety Information

I; II; III

6.1

UN3276 Nitriles, liquid, toxic, n.o.s., HazardClass: 6.1; Labels: 6.1-Poisonous materials, TechnicalName Required, Potential Inhalation Hazard (SpecialProvision 5).

3

22-36/37/38

22-24/25-36/37/39-26

QT3030000

Xn

Incompatible with strong oxidizing agents, strong reducing agents, strong acids, strong bases.

P261-P305 + P351 + P338

H302-H315-H319-H335

SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 209 companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H302: Harmful if swallowed [Warning Acute toxicity, oral]|P260, P264, P270, P280, P301+P312, P305+P351+P338, P309+P311, P314, P330, P337+P313, P405, and P501

Depending on the extent of possible contact, workers should be provided with personal protective equipment. A charcoal gas mask canister respirator has been found to be effective against a 2% pyridine concentration at 30 l/min for 1 hr. Rubber and plastic gloves should not be relied upon to prevent skin contact because pyridine and many of its derivatives penetrate these materials ... . /Pyridine, homologs, and derivatives/

SRP: The scientific literature for the use of contact lenses in industry is conflicting. The benefit or detrimental effects of wearing contact lenses depend not only upon the substance, but also on factors including the form of the substance, characteristics and duration of the exposure, the uses of other eye protection equipment, and the hygiene of the lenses. However, there may be individual substances whose irritating or corrosive properties are such that the wearing of contact lenses would be harmful to the eye. In those specific cases, contact lenses should not be worn. In any event, the usual eye protection equipment should be worn even when contact lenses are in place.

Pyridine and its derivatives cause local irritation on contact with the skin, mucous membranes and cornea. /Pyridine and its derivatives/

Toxicity

3-Pyridinecarbonitrile's production and use in organic synthesis(1) may result in its release to the environment through various waste streams(SRC).

TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 37(SRC), determined from a measured log Kow of 0.36(2) and a regression-derived equation(3), indicates that 3-pyridinecarbonitrile is expected to have very high mobility in soil(SRC). Volatilization of 3-pyridinecarbonitrile from moist soil surfaces is not expected to be an important fate process(SRC) given a Henry's Law constant of 2.74X10-7 atm-cu m/mole(4). 3-Pyridinecarbonitrile is not expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 0.296 mm Hg(5). In water, the maximum pseudo-first-order rate constant and half-life for 3-pyridinecarbonitrile in an anoxic sediment slurry from the estuary of the Tansui River (Guandu, Taipei) were 9.41 per day and 1.7 hrs, respectively(6) which suggests that 3-pyridinecarbonitrile may biodegrade in soil at least under anaerobic conditions(SRC).|AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 37(SRC), determined from a measured log Kow of 0.36(2) and a regression-derived equation(3), indicates that 3-pyridinecarbonitrile is not expected to adsorb to suspended solids and sediment(SRC). Volatilization from water surfaces is not expected(3) based upon a Henry's Law constant of 2.74X10-7 atm-cu m/mole(4). According to a classification scheme(5), an estimated BCF of 3(SRC), from its log Kow(2) and a regression-derived equation(6), suggests the potential for bioconcentration in aquatic organisms is low(SRC). The maximum pseudo-first-order rate constant and half-life for 3-pyridinecarbonitrile in an anoxic sediment slurry from the estuary of the Tansui River (Guandu, Taipei) were 9.41 per day and 1.7 hrs, respectively(7) which suggests that 3-pyridinecarbonitrile may degrade in the environment at least under anaerobic conditions(SRC).|ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), 3-pyridinecarbonitrile, which has a vapor pressure of 0.296 mm Hg at 25 °C(2), is expected to exist solely as a vapor in the ambient atmosphere(SRC). Vapor-phase 3-pyridinecarbonitrile is degraded in the atmosphere by reaction with photochemically-produced hydroxyl radicals(SRC); the half-life for this reaction in air is estimated to be 246 days(SRC), calculated from its rate constant of 6.53X10-14 cu cm/molecule-sec at 25 °C(SRC) determined using a structure estimation method(3).

The rate constant for the vapor-phase reaction of 3-pyridinecarbonitrile with photochemically-produced hydroxyl radicals has been estimated as 6.53X10-14 cu cm/molecule-sec at 25 °C(SRC) using a structure estimation method(1). This corresponds to an atmospheric half-life of about 246 days at an atmospheric concn of 5X10+5 hydroxyl radicals per cu cm(1). 3-Pyridinecarbonitrile is expected to undergo slow hydrolysis in the environment based upon the slow hydrolysis of other aromatic nitriles, eg, benzonitrile(2). 3-Pyridinecarbonitrile is also not expected to directly photolyze due to the lack of absorption in the environmental UV spectrum (>290 nm)(SRC).

An estimated BCF of 3 was calculated for 3-pyridinecarbonitrile(SRC), using a log Kow of 0.36(1) and a regression-derived equation(2). According to a classification scheme(3), this BCF suggests the potential for bioconcentration in aquatic organisms is low(SRC).

36.31 L/kg|The Koc of 3-pyridinecarbonitrile is estimated as 37(SRC), using a measured log Kow of 0.36(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that 3-pyridinecarbonitrile is expected to have very high mobility in soil(SRC).

The Henry's Law constant for 3-pyridinecarbonitrile is 2.74X10-7 atm-cu m/mole(1). This Henry's Law constant indicates that 3-pyridinecarbonitrile is not expected to volatilize from water and moist soil surfaces(2). 3-Pyridinecarbonitrile is not expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 0.296 mm Hg(3).

Occupational exposure to 3-pyridinecarbonitrile may occur through inhalation and dermal contact with this compound at workplaces where 3-pyridinecarbonitrile is produced or used. (SRC)

Drug Information

3-cyanopyridine

3-Cyanopyridine Use and Manufacturing

Methods of Manufacturing

Nicotinamide powder and phosphorus pentoxide are obtained by reactive distillation with a yield of 84%.

Uses

Intermediates for pharmaceuticals, pigments, resins, etc. 3-cyanopyridine is an important chemical intermediate. In the pharmaceutical industry, it is mainly used for the preparation of peripheral vasodilators-Nicotinyl alcohol.


Intermediates

Production

(1980) PROBABLY GREATER THAN 2.27X10+6 GRAMS

Food, beverage, and tobacco product manufacturing|3-Pyridinecarbonitrile: ACTIVE

VARIOUS TLC SYSTEMS FOR THE SEPARATION OF 2-, 3-, & 4-SUBSTITUTED PYRIDINES ARE DESCRIBED.|Pyridine and its derivatives in water and sediment were determined by gas chromatography. Recovery was 95, 90, and 84% from purified water, river water, and sediment, respectively. The detection limit was 0.001 mg/l water and 0.01 mg/l sediment. /Pyridine and its derivatives/

Computed Properties

Molecular Weight:104.11
XLogP3:0.2
Hydrogen Bond Acceptor Count:2
Exact Mass:104.037448136
Monoisotopic Mass:104.037448136
Topological Polar Surface Area:36.7
Heavy Atom Count:8
Complexity:111
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Price Analysis

Make your 3-Cyanopyridine purchase based on the price and market insights! ECHEMI provides professional market insights with prices for you to make a better choice. Learn more on 3-Cyanopyridine prices .

Recommended Suppliers of 3-Cyanopyridine

  • China CN

    4 YRS

    Business licensed
    Trader Supplier of 13-Dimethyladamantane,1-Bromo-35-dimethyladamantane,perhydroacenaphthylene,4-[1,1-bis(4-hydroxyphenyl)ethyl]phenol,CYCLOBUTANE-1,2-DICARBOXYLIC ACID DIMETHYL ESTER, TRANS
  • China CN

    5 YRS

    Business licensed
    Trader Supplier of Intermediates,Building blocks,API,Silicones,Peptides,Lab chemicals,Biochemicals,Pharmaceuticals,Screening Compounds,Food Additives
    CAS No.: 100-54-9
    Content: 99.00%
    Inquiry
  • China CN

    3 YRS

    Business licensed
    Trader Supplier of api,Intermediates,Organic Chemistry,Inorganic Chemistry,Daily Chemicals,Cosmetic Raw Materals,CATALYST AND AUXILIARY,FLAVORS AND FRAGRANCES,Chemical Pesticides,ADDITIVE
    CAS No.: 100-54-9
    Grade: pharmaceutical grade
    Content: 99%
    Inquiry
  • Malaysia MY

    3 YRS

    Business licensed Certified factory
    Manufactory Supplier of xylene,COCODIETHANOLAMIDE (CDEA),LINEAR ALKYL BENZENE SULFONIC ACID (LABSA),ethanol,soap noodles,caustic soda,thiourea,SODIUM LAURYL SULFATE,methanol,ISOPROPYL ALCOHOL,white spirit,PALM FATTY ACID OIL,PALM OIL STEARIN,N-HEXANE,SODIUM LAURYL ETHER SULPHATE,UREA FERTILIZER,CITRIC ACID MONOHYDRATE,XYLITOL,MENTHOL CRYSTAL,WHEAT GLUTEN,SOYBEAN LECITHIN,ALLULOSE SWEETENER,CORN STARCH,ASPARTAME,ICUMSA SUGAR 45,ASCORBIC ACID,PARAFFIN WAX,Polyethylene Glycol,Low density Polyethylene (LDPE),BITUMEN TAR,isopropyl alcohol (IPA),BORIC ACID,ETHYLENE GLYCOL,triethylene glycol,ANIONIC POLYACRYLAMIDE,ALKYLDIMETHYLBENZYL AMMONIUM CHLORIDE,HYPOCHLOROUS ACID,OXYGEN SCAVENGER,POLYMERIZATION ALUMINUM CHLORIDE (AI2CI(OH)5
    CAS No.: 100-54-9
    Content: 99%
    Inquiry
  • China CN

    4 YRS

    Business licensed
    Trader Supplier of 2-Aminobenzamide
    CAS No.: 100-54-9
    Grade: Industrial Grade
    Content: 99%
    Inquiry

Scan the QR Code to Share

Feedback & Suggestions
Send Message

Thank you for your feedback. If you require further assistance, please contact us by email at info@echemi.com or call us at +86-532-55729510.