CAS 2566-23-6 | (S);-2-Benzamido-3-(4-hydroxyphenyl);propanoic acid | CAS Number 2566-23-6

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2566-23-6 | (S);-2-Benzamido-3-(4-hydroxyphenyl);propanoic acid

CAS No: 2566-23-6 Catalog No: AG003SQV MDL No:MFCD01321140

Product Description

Catalog Number:

AG003SQV

Chemical Name:

(S);-2-Benzamido-3-(4-hydroxyphenyl);propanoic acid

CAS Number:

2566-23-6

Molecular Formula:

C16H15NO4

Molecular Weight:

285.2946

MDL Number:

MFCD01321140

IUPAC Name:

(2S)-2-benzamido-3-(4-hydroxyphenyl)propanoic acid

InChI:

InChI=1S/C16H15NO4/c18-13-8-6-11(7-9-13)10-14(16(20)21)17-15(19)12-4-2-1-3-5-12/h1-9,14,18H,10H2,(H,17,19)(H,20,21)/t14-/m0/s1

InChI Key:

KUUUDPTUEOKITK-AWEZNQCLSA-N

SMILES:

OC(=O)[C@@H](NC(=O)c1ccccc1)Cc1ccc(cc1)O

Properties

Complexity:

357

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

285.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

285.299g/mol

Monoisotopic Mass:

285.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Continuous micro-production using enzymatic reaction and online monitoring.	Chimia 20100101
Metabolite fingerprinting in transgenic Nicotiana tabacum altered by the Escherichia coli glutamate dehydrogenase gene.	Journal of biomedicine & biotechnology 20050101