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Chlorodifluoroacetic acid

Chlorodifluoroacetic acid structure

Chlorodifluoroacetic acid 

structure
  • CAS No:

    76-04-0

  • Formula:

    C2HClF2O2

  • Chemical Name:

    Chlorodifluoroacetic acid

  • Synonyms:

    Acetic acid,2-chloro-2,2-difluoro-;Acetic acid,chlorodifluoro-;2-Chloro-2,2-difluoroacetic acid;Chlorodifluoroacetic acid;Monochlorodifluoroacetic acid;NSC 60298;2,2-Difluoro-2-chloroacetic acid

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

CLEAR COLORLESS TO PALE BROWN LIQUID AFTER MELTING

Chlorodifluoroacetic acid Basic Attributes

130.475

130.48

200-928-8

60298

DTXSID8058792

2915900090

Characteristics

37.3

1.2

clear colorless to pale brown liquid after melting

1.7±0.1 g/cm3

25 °C

122 °C

25.9±25.9 °C

1.376

H2O: soluble

Keep in a cool, dry, dark location in a tightly sealed container or cylinder. Keep away from incompatible materials, ignition sources and untrained individuals. Secure and label area. Protect containers/cylinders from physical damage.

4.10e-08 atm-m3/mole

Safety Information

II

8

UN 3261 8/PG 2

3

R35

S26-S36/37/39-S45

C:Corrosive

P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, P501

H314

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 46 companies from 4 notifications to the ECHA C&L Inventory.

Drug Information

chlorodifluoroacetic acid

Chlorodifluoroacetic acid Use and Manufacturing

Methods of Manufacturing

(VO 504. 3 G (3. 87MOL) CHLORDIFLUORESSIGSaURE UND 5. 0 G p-Toluolsulfonsaure werden in 775 ml Methylenchlorid gelost und bei Raumtemperatur innerhalb von 30min mit 311. 6 G (6. 76 MOL) Ethanol versetzt (Temperaturanstieg auf 33oC). Man ruhrt 38 h unter Ruckfluss am Wasserabscheider nach und kuhlt auf Raumtemperatur ab. Zur Aufarbeitung wascht man mit Wasser (200 ml), gesattigter Natriumhydrogencarbonatlosung (200 ml) und erneut mit Wasser (200 ml), trocknet uber Natriumsulfat, filtriert und destilliert das Losungsmittel ab. Anschliesend wird durch fraktionierte Destillation WEITER AUFGEREINIGT ;-- Man erhalt 488.9 g (98% ig, 78.5 % der Theorie) an Chlordifluoressigsaureethylester (Siedepunkt 94- 96oC).

Acetic acid, 2-chloro-2,2-difluoro-: ACTIVE

Computed Properties

Molecular Weight:130.48
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:129.9633133
Monoisotopic Mass:129.9633133
Topological Polar Surface Area:37.3
Heavy Atom Count:7
Complexity:91.7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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