4'-Chloro-2'-methylacetanilide - CAS 5202-86-8

Catalog:	BB027687
Product Name:	4'-Chloro-2'-methylacetanilide
CAS:	5202-86-8
Synonyms:	N-(4-chloro-2-methylphenyl)acetamide; N-(4-chloro-2-methylphenyl)acetamide

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	N-(4-chloro-2-methylphenyl)acetamide
Description:	4'-Chloro-2'-methylacetanilide (CAS# 5202-86-8) is a useful research chemical.
Molecular Weight:	183.63
Molecular Formula:	C9H10ClNO
Canonical SMILES:	CC1=C(C=CC(=C1)Cl)NC(=O)C
InChI:	InChI=1S/C9H10ClNO/c1-6-5-8(10)3-4-9(6)11-7(2)12/h3-5H,1-2H3,(H,11,12)
InChI Key:	WMHHXYOPEQARIN-UHFFFAOYSA-N
Boiling Point:	324.3 °C at 760 mmHg
Density:	1.218 g/cm³
MDL:	MFCD00027399
LogP:	2.67980

Publication Number	Title	Priority Date
CN-113461541-A	Method for synthesizing p-chloro-o-toluidine	20210701
US-10981868-B1	Single step regioselective cyclization and chlorination of hydroxyamino-N-(2-methylphenyl)acetamide to 5-chloro-7-methylindoline-2,3-dione	20200812
WO-2021113682-A1	Masp-2 inhibitors and methods of use	20191204
WO-2021113686-A1	Masp-2 inhibitors and methods of use	20191204
WO-2021113690-A1	Masp-2 inhibitors and methods of use	20191204

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[87-88-7]
Chloranilic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	172
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	183.0450916
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	183.0450916
Rotatable Bond Count:	1
Topological Polar Surface Area:	29.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2