Name: Name:2-(4-carbamoylphenyl)acetic acid
Brand: Angene
SKU: AG01A70C
Rating: 90 (10 reviews)

2-(4-carbamoylphenyl)acetic acid

CAS No.:

2393-28-4

Catalog Number:

AG01A70C

Molecular Formula:

C9H9NO3

Molecular Weight:

179.1727

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Product Description

Catalog Number:

AG01A70C

Chemical Name:

2-(4-carbamoylphenyl)acetic acid

CAS Number:

2393-28-4

Molecular Formula:

C9H9NO3

Molecular Weight:

179.1727

MDL Number:

MFCD20639603

IUPAC Name:

2-(4-carbamoylphenyl)acetic acid

InChI:

InChI=1S/C9H9NO3/c10-9(13)7-3-1-6(2-4-7)5-8(11)12/h1-4H,5H2,(H2,10,13)(H,11,12)

InChI Key:

ZGWAEKSJTSFZSS-UHFFFAOYSA-N

SMILES:

OC(=O)Cc1ccc(cc1)C(=O)N

Properties

Complexity:

207

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

179.058g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

179.175g/mol

Monoisotopic Mass:

179.058g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5

Literature

Title	Journal
Identification of an ISR-related metabolite produced by Pseudomonas chlororaphis O6 against the wildfire pathogen pseudomonas syringae pv.tabaci in tobacco.	Journal of microbiology and biotechnology 20081001