200,000+ products from a single source!
sales@angenechem.com
1217859-58-9 | Benzenepropanol, γ-amino-3-chloro-, hydrochloride (1:1), (γS)-
CAS No: 1217859-58-9 Catalog No: AG001613 MDL No:
Product Description
Catalog Number:
AG001613
Chemical Name:
Benzenepropanol, γ-amino-3-chloro-, hydrochloride (1:1), (γS)-
CAS Number:
1217859-58-9
Molecular Formula:
C9H13Cl2NO
Molecular Weight:
222.1116
IUPAC Name:
(2S)-2-amino-3-(3-chlorophenyl)propan-1-ol;hydrochloride
InChI:
InChI=1S/C9H12ClNO.ClH/c10-8-3-1-2-7(4-8)5-9(11)6-12;/h1-4,9,12H,5-6,11H2;1H/t9-;/m0./s1
InChI Key:
PCMUNXWULDZUCG-FVGYRXGTSA-N
SMILES:
OC[C@H](Cc1cccc(c1)Cl)N.Cl
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
221.037g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
222.109g/mol
Monoisotopic Mass:
221.037g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.