4-Chloroacetanilide

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Names

[ CAS No. ]:
539-03-7

[ Name ]:
4-Chloroacetanilide

[Synonym ]:
N-(4-Chlorophenyl)acetamide
4‘-Chloroacetanilide
EINECS 208-707-8
4'-chloroacetanilide
p-Chloroacetanilide
MFCD00000612
Acetamide, N-(4-chlorophenyl)-
Acetic acid 4-chloroanilide
4-Chloroacetanilide

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
335.0±25.0 °C at 760 mmHg

[ Melting Point ]:
176-178 °C(lit.)

[ Molecular Formula ]:
C8H8ClNO

[ Molecular Weight ]:
169.608

[ Flash Point ]:
156.4±23.2 °C

[ Exact Mass ]:
169.029449

[ PSA ]:
29.10000

[ LogP ]:
2.05

[ Vapour Pressure ]:
0.0±0.7 mmHg at 25°C

[ Index of Refraction ]:
1.591

[ Water Solubility ]:
dioxane: 50 mg/mL hot, clear

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AE1001000
CHEMICAL NAME :
Acetanilide, 4'-chloro-
CAS REGISTRY NUMBER :
539-03-7
BEILSTEIN REFERENCE NO. :
0509638
LAST UPDATED :
199710
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C8-H8-Cl-N-O
MOLECULAR WEIGHT :
169.62
WISWESSER LINE NOTATION :
GR DMV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
245 mg/kg
TOXIC EFFECTS :
Nutritional and Gross Metabolic - body temperature decrease
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
730 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 :
2500 ug/plate
REFERENCE :
PCBPBS Pesticide Biochemistry and Physiology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1971- Volume(issue)/page/year: 10,174,1979

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 ]:
3

[ RTECS ]:
AE1001000

[ HS Code ]:
2924299090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 4-Chloronitrobenzene
  • Thioacetic acid
  • Acetamide
  • 4-Chloroaniline
  • 1-Chloro-4-iodobenzene
  • acetic acid
  • 4-Bromochlorobenzene
  • Ethanoic anhydride
  • Acetyl chloride
  • 1-(4-Chlorophenyl)ethanone

DownStream

  • 4-CYANOACETANILIDE
  • 3-(trifluoromethyl)acetanilide
  • N-(2-Bromo-4-chloro-phenyl)acetamide
  • 1-Bromo-4-chloro-2-nitrobenzene
  • 2-Chloro-4-methyl-benzothiozole
  • 8-Chloro-11-oxo-10,11-dihydro-5H-dibenzo-1,4-diazepine
  • 3,7-dichloro-1-oxido-1,2,4-benzotriazin-1-ium
  • Formamidine, N- (p-chlorophenyl)-N,N-dimethyl-
  • 2,6-Dichloroquinoline-3-carbaldehyde
  • N-chloro-N-(4-chlorophenyl)acetamide

Customs

[ HS Code ]: 2924299090

[ Summary ]:
2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Articles

Development of EPA method 535 for the determination of chloroacetanilide and other acetamide herbicide degradates in drinking water by solid-phase extraction and liquid chromatography/tandem mass spectrometry.

J. AOAC Int. 89(1) , 201-9, (2006)

U.S. Environmental Protection Agency (EPA) Method 535 has been developed in order to provide a method for the analysis of "Alachlor ESA and other acetanilide degradation products," which are listed on...

Toxicology laboratory analysis and human exposure to p-chloroaniline.

Clin. Toxicol. (Phila.) 47(2) , 132-6, (2009)

p-Chloroaniline is more potent at producing methemoglobin than aniline in animal models. This case highlights the clinical presentation of an inhalation exposure to p-chloroaniline and associated labo...

Structural characterization and function determination of a nonspecific carboxylate esterase from the amidohydrolase superfamily with a promiscuous ability to hydrolyze methylphosphonate esters.

Biochemistry 53(21) , 3476-85, (2014)

The uncharacterized protein Rsp3690 from Rhodobacter sphaeroides is a member of the amidohydrolase superfamily of enzymes. In this investigation the gene for Rsp3690 was expressed in Escherichia coli ...


More Articles

Related Compounds

  • 3-NITRO-4-CHLOROACETANILIDE
  • 3-Amino-4-Chloroacetanilide
  • N-bromo-4-chloroacetanilide
  • 3-bromo-4-chloroacetanilide
  • 2-hydroxy-4-chloroacetanilide
  • N-Hydroxy-4-chloroacetanilide
  • N-(4-chlorophenyl)-2-[4-(3-methoxyphenyl)-2-methyl-6-oxo-1,6-dihydropyrimidin-1-yl]acetamide
  • [7-(3-Bromophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl](4-methylpiperazino)methanone
  • [7-(2-Chlorophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl](4-methylpiperazino)methanone
  • N-(Guanosin-8-yl)-2-aminofluorene
  • tert-Butyl 4-(((4-bromopyridin-2-yl)amino)methyl)piperidine-1-carboxylate
  • 4-(1-Hydroxycyclopropyl)thiophene-2-sulfonamide
  • 6-Chloro-2-(ethylamino)-5-iodopyrimidin-4(3H)-one
  • 4-(4-Amino-1,2-oxazol-5-yl)phenol
  • methyl (2R)-2-amino-3-ethoxypropanoate
  • 2,6-Difluoro-3-(nonylamino)benzamide