CAS 539-03-7|4-Chloroacetanilide

Introduction：Basic information about CAS 539-03-7|4-Chloroacetanilide, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
MUTATION DATA
4. Safety Information
5. Customs
6. Articles6
7. Synonyms

Common Name	4-Chloroacetanilide
CAS Number	539-03-7	Molecular Weight	169.608
Density	1.3±0.1 g/cm3	Boiling Point	335.0±25.0 °C at 760 mmHg
Molecular Formula	C₈H₈ClNO	Melting Point	176-178 °C(lit.)
MSDS	ChineseUSA	Flash Point	156.4±23.2 °C
Symbol	GHS07	Signal Word	Warning

Names

Name	4-chloroacetanilide
Synonym	More Synonyms

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
InChIKey	GGUOCFNAWIODMF-UHFFFAOYSA-N
SMILES	CC(=O)Nc1ccc(Cl)cc1
Water Solubility	dioxane: 50 mg/mL hot, clear

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

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%

Articles6

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 ...

Synonyms

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

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