Name: Name:Benzoic acid,2-(acetylmethylamino)-
Brand: Angene
SKU: AG008NDD
Rating: 90 (10 reviews)

Benzoic acid,2-(acetylmethylamino)-

CAS No.:

78944-67-9

Catalog Number:

AG008NDD

Molecular Formula:

C10H11NO3

Molecular Weight:

193.1992

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Product Description

Catalog Number:

AG008NDD

Chemical Name:

Benzoic acid,2-(acetylmethylamino)-

CAS Number:

78944-67-9

Molecular Formula:

C10H11NO3

Molecular Weight:

193.1992

MDL Number:

MFCD00514134

IUPAC Name:

2-[acetyl(methyl)amino]benzoic acid

InChI:

InChI=1S/C10H11NO3/c1-7(12)11(2)9-6-4-3-5-8(9)10(13)14/h3-6H,1-2H3,(H,13,14)

InChI Key:

VCOQVAJFXPHUAM-UHFFFAOYSA-N

SMILES:

CC(=O)N(c1ccccc1C(=O)O)C

Properties

Complexity:

240

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

193.074g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

193.202g/mol

Monoisotopic Mass:

193.074g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101

Properties