200,000+ products from a single source!
sales@angenechem.com
156332-46-6 | Acetic acid, 2-[(S)-(carboxymethyl)sulfinyl]-, 1-methyl ester
CAS No: 156332-46-6 Catalog No: AG001OOB MDL No:
Product Description
Catalog Number:
AG001OOB
Chemical Name:
Acetic acid, 2-[(S)-(carboxymethyl)sulfinyl]-, 1-methyl ester
CAS Number:
156332-46-6
Molecular Formula:
C5H8O5S
Molecular Weight:
180.1790
IUPAC Name:
2-[(S)-(2-methoxy-2-oxoethyl)sulfinyl]acetic acid
InChI:
InChI=1S/C5H8O5S/c1-10-5(8)3-11(9)2-4(6)7/h2-3H2,1H3,(H,6,7)/t11-/m0/s1
InChI Key:
LKOZEGJLDIXKIU-NSHDSACASA-N
SMILES:
COC(=O)C[S@@](=O)CC(=O)O
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
180.009g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.174g/mol
Monoisotopic Mass:
180.009g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
99.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.