200,000+ products from a single source!
sales@angenechem.com
85391-15-7 | Benzenepropanoic acid, a-hydroxy-, sodium salt (1:1), (aR)-
CAS No: 85391-15-7 Catalog No: AG004OX0 MDL No:
Product Description
Catalog Number:
AG004OX0
Chemical Name:
Benzenepropanoic acid, a-hydroxy-, sodium salt (1:1), (aR)-
CAS Number:
85391-15-7
Molecular Formula:
C9H9NaO3
Molecular Weight:
188.1557
IUPAC Name:
sodium;(2R)-2-hydroxy-3-phenylpropanoate
InChI:
InChI=1S/C9H10O3.Na/c10-8(9(11)12)6-7-4-2-1-3-5-7;/h1-5,8,10H,6H2,(H,11,12);/q;+1/p-1/t8-;/m1./s1
InChI Key:
DVSAFLNBVQKEKE-DDWIOCJRSA-M
SMILES:
O[C@@H](C(=O)[O-])Cc1ccccc1.[Na+]
EC Number:
286-767-4
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
188.045g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.158g/mol
Monoisotopic Mass:
188.045g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.