4′-Chloroacetoacetanilide

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Names

[ CAS No. ]:
140-49-8

[ Name ]:
4′-Chloroacetoacetanilide

[Synonym ]:
1-Acetamido-4-chloroacetylbenzene
GR DMV1V1
N-(4-Chlorphenyl)-3-oxobutanamide
N-(4-Chlorophenyl)acetoacetamide
4-acetaminophenacyl chloride
Acetoacetanilide, 4'-chloro-
EINECS 205-416-8
Butanamide, N-(4-chlorophenyl)-3-oxo-
N-[4-(2-chloroacetyl)phenyl]acetamide
MFCD00040869
p-chloroacetylacetanilide
p-Acetamidophenacyl chloride
4-acetylaminophenacyl chloride
Acetoacetanilide, p-chloro-
N-(4-Chlorophenyl)-3-oxobutanamide
4′-Chloroacetoacetanilide
4'-Chloroacetoacetanilide

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
400.5±30.0 °C at 760 mmHg

[ Melting Point ]:
216-219 °C(lit.)

[ Molecular Formula ]:
C10H10ClNO2

[ Molecular Weight ]:
211.645

[ Flash Point ]:
196.0±24.6 °C

[ Exact Mass ]:
211.040009

[ PSA ]:
46.17000

[ LogP ]:
1.82

[ Vapour Pressure ]:
0.0±0.9 mmHg at 25°C

[ Index of Refraction ]:
1.579

[ Water Solubility ]:
<0.1 g/100 mL at 19 ºC

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AE1050000
CHEMICAL NAME :
Acetanilide, 4'-(chloroacetyl)-
CAS REGISTRY NUMBER :
140-49-8
BEILSTEIN REFERENCE NO. :
2724140
LAST UPDATED :
199701
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C10-H10-Cl-N-O2
MOLECULAR WEIGHT :
211.66
WISWESSER LINE NOTATION :
G1VR DMV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
2150 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1470 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
3300 ng/plate
REFERENCE :
ENMUDM Environmental Mutagenesis. (New York, NY) V.1-9, 1979-87. For publisher information, see EMMUEG. Volume(issue)/page/year: 7(Suppl 5),1,1985

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ RTECS ]:
AE1050000

[ HS Code ]:
2925190090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Chloroacetyl chloride
  • Acetanilide
  • 4-Aminoacetophenone

DownStream

  • 4-(2-Phenyl-1,3-thiazol-4-yl)aniline
  • 1-(4-Aminophenyl)-2-chloroethanone
  • 4-(2-methyl-1,3-thiazol-4-yl)aniline
  • 4'-ACETAMIDOACETOPHENONE
  • 4-Acetamidobenzoic acid
  • n-(4-(4-amino-3,5-thiazolyl)phenyl)ethanamide
  • 4-Acetyamino-3-nitrophenacyl chloride
  • 4-(4-aminophenyl)-N-(2-chlorophenyl)-1,3-thiazol-2-amine
  • N-[4-(4-Aminophenyl)-2-thiazolyl]-2-pyridinamine
  • 4-(2-(4-METHOXYPHENYL)THIAZOL-4-YL)BENZENAMINE

Customs

[ HS Code ]: 2925190090

[ Summary ]:
2925190090 other imides and their derivatives; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Related Compounds

  • 4′-Chloroacetoacetanilide
  • 4′-methyl-5-(5-trifluoromethyltetrazol-1-yl)biphenyl-3-carboxylic acid
  • 4′-methyl-5-(5-trifluoromethyltetrazol-1-yl)biphenyl-3-carboxylic acid methyl ester
  • 4′-(3,5-dibromophenyl)-2,2′:6′,2″-terpyridine
  • (4′-methylbiphenyl-2-yl)(phenyl)methanone
  • 4′-Nitro(1,1′-biphenyl)-carbonsure, Na-Salz
  • Ethyl 4-(1-acetylpiperidin-4-yl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylate
  • 3-Isopropyl-4-(4-methoxypiperidin-1-yl)-1-(6-morpholinopyridin-2-yl)-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid
  • Ethyl 1-cyclohexyl-3-isopropyl-4-(4-methoxypiperidin-1-yl)-1H-pyrazolo[3,4-b]pyridine-6-carboxylate
  • Methyl 1-(4-fluorophenyl)-4-(4-(hydroxymethyl)piperidin-1-yl)-3-isopropyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylate
  • 5-Chloro-6-methyl-N4-(2-(1-methylpiperidin-3-yl)ethyl)pyrimidine-2,4-diamine
  • 4-Chloro-1-cyclohexyl-3-isopropyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid
  • 3-Cyclobutyl-4-[4-(2-hydroxyethyl)-1-piperazinyl]-1-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid
  • 4-Chloro-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid
  • 3-Cyclobutyl-4-(4-formyl-1-piperidinyl)-1-phenyl-1H-pyrazolo[3,4-b]pyridine-6-carboxylic acid
  • Ethyl 3-cyclobutyl-4-(4-morpholinophenyl)-1H-pyrazolo[3,4-b]pyridine-6-carboxylate
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