200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 139650-41-2
139650-41-2 | 1,3-Dithiol-2-one, 4,4'-[methylenebis(thio)]bis[5-(methylthio)- (9CI)
CAS No: 139650-41-2 Catalog No: AG001BGI MDL No:
Product Description
Catalog Number:
AG001BGI
Chemical Name:
1,3-Dithiol-2-one, 4,4'-[methylenebis(thio)]bis[5-(methylthio)- (9CI)
CAS Number:
139650-41-2
Molecular Formula:
C9H8O2S8
Molecular Weight:
404.6786
IUPAC Name:
4-methylsulfanyl-5-[(5-methylsulfanyl-2-oxo-1,3-dithiol-4-yl)sulfanylmethylsulfanyl]-1,3-dithiol-2-one
InChI:
InChI=1S/C9H8O2S8/c1-12-4-6(18-8(10)16-4)14-3-15-7-5(13-2)17-9(11)19-7/h3H2,1-2H3
InChI Key:
FTEZHFLAVISTMH-UHFFFAOYSA-N
SMILES:
CSc1sc(=O)sc1SCSc1sc(=O)sc1SC
Properties
Complexity:
427
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
403.829g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
404.641g/mol
Monoisotopic Mass:
403.829g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
237A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.