Name: Name:Benzenebutanoic acid, a-amino-4-hydroxy-, (aS)-
Brand: Angene
SKU: AG00I4CO
Rating: 90 (10 reviews)

Benzenebutanoic acid, a-amino-4-hydroxy-, (aS)-

CAS No.:

221243-01-2

Catalog Number:

AG00I4CO

Molecular Formula:

C10H13NO3

Molecular Weight:

195.2151

Catalog Number:

AG00I4CO

Chemical Name:

Benzenebutanoic acid, a-amino-4-hydroxy-, (aS)-

CAS Number:

221243-01-2

Molecular Formula:

C10H13NO3

Molecular Weight:

195.2151

MDL Number:

MFCD01075127

IUPAC Name:

(2S)-2-amino-4-(4-hydroxyphenyl)butanoic acid

InChI:

InChI=1S/C10H13NO3/c11-9(10(13)14)6-3-7-1-4-8(12)5-2-7/h1-2,4-5,9,12H,3,6,11H2,(H,13,14)/t9-/m0/s1

InChI Key:

LOOZZTFGSTZNRX-VIFPVBQESA-N

SMILES:

OC(=O)[C@H](CCc1ccc(cc1)O)N

UNII:

15X6A9Y291

Complexity:

188

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

195.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

195.218g/mol

Monoisotopic Mass:

195.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.6