N-(3-Chloro-4-methylphenyl)acetamide - CAS 7149-79-3

Catalog:	BB034405
Product Name:	N-(3-Chloro-4-methylphenyl)acetamide
CAS:	7149-79-3
Synonyms:	N-(3-chloro-4-methylphenyl)acetamide; N-(3-chloro-4-methylphenyl)acetamide

Technical Data

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Patents

Computed Properties

IUPAC Name:	N-(3-chloro-4-methylphenyl)acetamide
Description:	N-(3-Chloro-4-methylphenyl)acetamide (CAS# 7149-79-3 ) is a useful research chemical.
Molecular Weight:	183.63
Molecular Formula:	C9H10ClNO
Canonical SMILES:	CC1=C(C=C(C=C1)NC(=O)C)Cl
InChI:	InChI=1S/C9H10ClNO/c1-6-3-4-8(5-9(6)10)11-7(2)12/h3-5H,1-2H3,(H,11,12)
InChI Key:	IGLVCWPPISIXPR-UHFFFAOYSA-N
Boiling Point:	333.3 °C at 760 mmHg
Density:	1.218 g/cm³
MDL:	MFCD00032582
LogP:	2.67980

Publication Number	Title	Priority Date
WO-2021047674-A1	Bicyclic compound that acts as crbn protein regulator	20190912
CN-109232544-B	Preparation method of prucalopride	20180907
EP-3429355-B1	Substituted sulfonylamide for combating animal pests	20160315
WO-2017157735-A1	Substituted sulfonyl amides for controlling animal pests	20160315
US-2018148392-A1	Separating agent for optical isomers	20150514

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Related Functional Groups

Carbonyl Compounds

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GHS Hazard Statement:	H300 (90.48%): Fatal if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P310, P321, P330, 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:	2.7