Name: Name:Benzoic acid, 2-amino-4-(hydroxymethyl)-, methyl ester
Brand: Angene
SKU: AG0080AT
Rating: 90 (10 reviews)

Benzoic acid, 2-amino-4-(hydroxymethyl)-, methyl ester

CAS No.:

133728-31-1

Catalog Number:

AG0080AT

Molecular Formula:

C9H11NO3

Molecular Weight:

181.1885

Catalog Number:

AG0080AT

Chemical Name:

Benzoic acid, 2-amino-4-(hydroxymethyl)-, methyl ester

CAS Number:

133728-31-1

Molecular Formula:

C9H11NO3

Molecular Weight:

181.1885

MDL Number:

MFCD20483323

IUPAC Name:

methyl 2-amino-4-(hydroxymethyl)benzoate

InChI:

InChI=1S/C9H11NO3/c1-13-9(12)7-3-2-6(5-11)4-8(7)10/h2-4,11H,5,10H2,1H3

InChI Key:

KAVHHQDCLHUMBC-UHFFFAOYSA-N

SMILES:

COC(=O)c1ccc(cc1N)CO

Complexity:

184

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

181.074g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

181.191g/mol

Monoisotopic Mass:

181.074g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: