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Home > Encyclopedia > N-(4-Chlorophenyl)-3-oxobutanamide

N-(4-Chlorophenyl)-3-oxobutanamide

N-(4-Chlorophenyl)-3-oxobutanamide structure

N-(4-Chlorophenyl)-3-oxobutanamide 

structure
  • CAS No:

    101-92-8

  • Formula:

    C10H10ClNO2

  • Chemical Name:

    N-(4-Chlorophenyl)-3-oxobutanamide

  • Synonyms:

    Butanamide,N-(4-chlorophenyl)-3-oxo-;Acetoacetanilide,4′-chloro-;N-(4-Chlorophenyl)-3-oxobutanamide;Acetoacet-p-chloroanilide;p-Chloroacetoacetanilide;4′-Chloroacetoacetanilide;N-(4-Chlorophenyl)acetoacetamide;NSC 3544;N-(4-Chlorophenyl)acetylacetamide;1258964-44-1

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

off-white to beige crystalline powder


P-Chloroacetoacetanilide is an anilide.

N-(4-Chlorophenyl)-3-oxobutanamide Basic Attributes

211.64

211.64

202-989-6

421YJ21R1J

3544

DTXSID3036654

CRYSTALS FROM ETHER, ALCOHOL

29242990

Characteristics

46.17000

1.82

white crystalline powder

1.44 g/cm3 (20℃)

66-67 °C

303°C (rough estimate)

350°F(COC)

1.5388 (estimate)

acetone: soluble 25mg/mL, clear, colorless to light yellow

Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

1.26E-06mmHg at 25°C

7.31

ipr-mus LDLo 500 mg/kg CBCCT* 4,225,52

Safety Information

NONH for all modes of transport

1

24/25

AK4375000

Stable under normal temperatures and pressures.

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362

H315

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

N-(4-Chlorophenyl)-3-oxobutanamide Use and Manufacturing

Methods of Manufacturing

PROBABLY BY REACTION OF ANILINE AND ACETOACETIC ESTERS, FOLLOWED BY CHLORINATION IN THE PRESENCE OF ACETIC ACID

Uses

CHEMICAL INTERMEDIATE FOR CI SOLUBILIZED VAT YELLOW 8

Production

(1977) No Data|(1979) No Data

Butanamide, N-(4-chlorophenyl)-3-oxo-: INACTIVE|4 P-SUBSTITUTED ACETOACETANILIDES COMPARED WITH ACETOACETANILIDE AS BACTERICIDES AGAINST MICROCOCCUS, STAPHYLOCOCCUS & SARCINA. P-CHLOROACETOACETANILIDE MORE ACTIVE THAN ACETOACETANILIDE.

Computed Properties

Molecular Weight:211.64
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:211.0400063
Monoisotopic Mass:211.0400063
Topological Polar Surface Area:46.2
Heavy Atom Count:14
Complexity:222
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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