200,000+ products from a single source!
sales@angenechem.com
14513-20-3 | 1,2-Benzenediol, 4-[(2S)-2-aminopropyl]-
CAS No: 14513-20-3 Catalog No: AG001KLU MDL No:
Product Description
Catalog Number:
AG001KLU
Chemical Name:
1,2-Benzenediol, 4-[(2S)-2-aminopropyl]-
CAS Number:
14513-20-3
Molecular Formula:
C9H13NO2
Molecular Weight:
167.2050
IUPAC Name:
4-[(2S)-2-aminopropyl]benzene-1,2-diol
InChI:
InChI=1S/C9H13NO2/c1-6(10)4-7-2-3-8(11)9(12)5-7/h2-3,5-6,11-12H,4,10H2,1H3/t6-/m0/s1
InChI Key:
KSRGADMGIRTXAF-LURJTMIESA-N
SMILES:
C[C@@H](Cc1ccc(c(c1)O)O)N
UNII:
RSZ6WC1175
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
167.095g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
167.208g/mol
Monoisotopic Mass:
167.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.