CAS 16555-77-4 | Acetic acid, 2-(benzoylamino)-2-hydroxy- | CAS Number 16555-77-4

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16555-77-4 | Acetic acid, 2-(benzoylamino)-2-hydroxy-

CAS No: 16555-77-4 Catalog No: AG001W7Z MDL No:MFCD00004228

Product Description

Catalog Number:

AG001W7Z

Chemical Name:

Acetic acid, 2-(benzoylamino)-2-hydroxy-

CAS Number:

16555-77-4

Molecular Formula:

C9H9NO4

Molecular Weight:

195.1721

MDL Number:

MFCD00004228

IUPAC Name:

2-benzamido-2-hydroxyacetic acid

InChI:

InChI=1S/C9H9NO4/c11-7(10-8(12)9(13)14)6-4-2-1-3-5-6/h1-5,8,12H,(H,10,11)(H,13,14)

InChI Key:

GCWCVCCEIQXUQU-UHFFFAOYSA-N

SMILES:

OC(C(=O)O)NC(=O)c1ccccc1

EC Number:

240-619-5

Properties

Complexity:

223

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

195.053g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

195.174g/mol

Monoisotopic Mass:

195.053g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2

Literature

Title	Journal
Urinary metabolite variation is associated with pathological progression of the post-hepatitis B cirrhosis patients.	Journal of proteome research 20120706
Amidation of bioactive peptides: the structure of the lyase domain of the amidating enzyme.	Structure (London, England : 1993) 20090715
Complex aetiology of an apparently Mendelian form of mental retardation.	BMC medical genetics 20080101
Role for an essential tyrosine in peptide amidation.	The Journal of biological chemistry 20060728
An enzyme-coupled assay for glyoxylic acid.	Analytical biochemistry 20031215