Name: Name:Benzeneacetic acid, a,3-dihydroxy-4-methoxy-
Brand: Angene
SKU: AG00BYAM
Rating: 90 (10 reviews)

Benzeneacetic acid, a,3-dihydroxy-4-methoxy-

CAS No.:

3695-24-7

Catalog Number:

AG00BYAM

Molecular Formula:

C9H10O5

Molecular Weight:

198.1727

Catalog Number:

AG00BYAM

Chemical Name:

Benzeneacetic acid, a,3-dihydroxy-4-methoxy-

CAS Number:

3695-24-7

Molecular Formula:

C9H10O5

Molecular Weight:

198.1727

MDL Number:

MFCD00004230

IUPAC Name:

2-hydroxy-2-(3-hydroxy-4-methoxyphenyl)acetic acid

InChI:

InChI=1S/C9H10O5/c1-14-7-3-2-5(4-6(7)10)8(11)9(12)13/h2-4,8,10-11H,1H3,(H,12,13)

InChI Key:

PXMUSCHKJYFZFD-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1O)C(C(=O)O)O

EC Number:

223-017-7

Complexity:

205

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

198.053g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

198.174g/mol

Monoisotopic Mass:

198.053g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.4