200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 89523-59-1
89523-59-1 | 2-Propanesulfinothioic acid, 2-methyl-, S-phenyl ester
CAS No: 89523-59-1 Catalog No: AG0040QR MDL No:
Product Description
Catalog Number:
AG0040QR
Chemical Name:
2-Propanesulfinothioic acid, 2-methyl-, S-phenyl ester
CAS Number:
89523-59-1
Molecular Formula:
C10H14OS2
Molecular Weight:
214.3476
IUPAC Name:
tert-butylsulfinylsulfanylbenzene
InChI:
InChI=1S/C10H14OS2/c1-10(2,3)13(11)12-9-7-5-4-6-8-9/h4-8H,1-3H3
InChI Key:
XGZJCRFRKZOEFC-UHFFFAOYSA-N
SMILES:
CC(S(=O)Sc1ccccc1)(C)C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.049g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.341g/mol
Monoisotopic Mass:
214.049g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.