CAS 103-88-8 | N-(4-Bromophenyl);acetamide | CAS Number 103-88-8

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103-88-8 | N-(4-Bromophenyl);acetamide

CAS No: 103-88-8 Catalog No: AG003KZB MDL No:MFCD00000092

Product Description

Catalog Number:

AG003KZB

Chemical Name:

N-(4-Bromophenyl);acetamide

CAS Number:

103-88-8

Molecular Formula:

C8H8BrNO

Molecular Weight:

214.0592

MDL Number:

MFCD00000092

IUPAC Name:

N-(4-bromophenyl)acetamide

InChI:

InChI=1S/C8H8BrNO/c1-6(11)10-8-4-2-7(9)3-5-8/h2-5H,1H3,(H,10,11)

InChI Key:

MSLICLMCQYQNPK-UHFFFAOYSA-N

SMILES:

CC(=O)Nc1ccc(cc1)Br

EC Number:

203-154-9

UNII:

4KB44F25A3

Properties

Complexity:

141

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

212.979g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

214.062g/mol

Monoisotopic Mass:

212.979g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Identification of the urinary metabolites of 4-bromoaniline and 4-bromo-[carbonyl-13C]-acetanilide in rat.	Xenobiotica; the fate of foreign compounds in biological systems 20020401