200,000+ products from a single source!
sales@angenechem.com
132665-45-3 | 2-Oxiranecarboxylic acid, 3-butyl-, (2S,3R)-
CAS No: 132665-45-3 Catalog No: AG0010Z3 MDL No:
Product Description
Catalog Number:
AG0010Z3
Chemical Name:
2-Oxiranecarboxylic acid, 3-butyl-, (2S,3R)-
CAS Number:
132665-45-3
Molecular Formula:
C7H12O3
Molecular Weight:
144.1684
IUPAC Name:
(2S,3R)-3-butyloxirane-2-carboxylic acid
InChI:
InChI=1S/C7H12O3/c1-2-3-4-5-6(10-5)7(8)9/h5-6H,2-4H2,1H3,(H,8,9)/t5-,6+/m1/s1
InChI Key:
HOZQSRMTDXZVPJ-RITPCOANSA-N
SMILES:
CCCC[C@H]1O[C@@H]1C(=O)O
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
144.079g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
144.17g/mol
Monoisotopic Mass:
144.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.