Name: Name:Benzenepropanoic acid, b-amino-3-hydroxy-, (bR)-
Brand: Angene
SKU: AG00ICX2
Rating: 90 (10 reviews)

Benzenepropanoic acid, b-amino-3-hydroxy-, (bR)-

CAS No.:

780749-95-3

Catalog Number:

AG00ICX2

Molecular Formula:

C9H11NO3

Molecular Weight:

181.1885

Catalog Number:

AG00ICX2

Chemical Name:

Benzenepropanoic acid, b-amino-3-hydroxy-, (bR)-

CAS Number:

780749-95-3

Molecular Formula:

C9H11NO3

Molecular Weight:

181.1885

MDL Number:

MFCD04113657

IUPAC Name:

(3R)-3-amino-3-(3-hydroxyphenyl)propanoic acid

InChI:

InChI=1S/C9H11NO3/c10-8(5-9(12)13)6-2-1-3-7(11)4-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m1/s1

InChI Key:

NYHNEKBZZXSUNO-MRVPVSSYSA-N

SMILES:

OC(=O)C[C@H](c1cccc(c1)O)N

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:

83.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-2.3