200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 80318-99-6
80318-99-6 | S-PHENYL 2,2-DIMETHYL-PROPANE-THIOSULFINATE
CAS No: 80318-99-6 Catalog No: AG005MKI MDL No:
Product Description
Catalog Number:
AG005MKI
Chemical Name:
S-PHENYL 2,2-DIMETHYL-PROPANE-THIOSULFINATE
CAS Number:
80318-99-6
Molecular Formula:
C11H16OS2
Molecular Weight:
228.3741
IUPAC Name:
2,2-dimethylpropylsulfinylsulfanylbenzene
InChI:
InChI=1S/C11H16OS2/c1-11(2,3)9-14(12)13-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChI Key:
WJBMZYZEDVRHHS-UHFFFAOYSA-N
SMILES:
CC(CS(=O)Sc1ccccc1)(C)C
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.064g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.368g/mol
Monoisotopic Mass:
228.064g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.