200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 19018-16-7
19018-16-7 | Ethanone, 2,2'-(1,2,4-trithiolane-3,5-diylidene)bis[1-(4-methylphenyl)- (9CI)
CAS No: 19018-16-7 Catalog No: AG002EDD MDL No:
Product Description
Catalog Number:
AG002EDD
Chemical Name:
Ethanone, 2,2'-(1,2,4-trithiolane-3,5-diylidene)bis[1-(4-methylphenyl)- (9CI)
CAS Number:
19018-16-7
Molecular Formula:
C20H16O2S3
Molecular Weight:
384.5348
IUPAC Name:
1-(4-methylphenyl)-2-[5-[2-(4-methylphenyl)-2-oxoethylidene]-1,2,4-trithiolan-3-ylidene]ethanone
InChI:
InChI=1S/C20H16O2S3/c1-13-3-7-15(8-4-13)17(21)11-19-23-20(25-24-19)12-18(22)16-9-5-14(2)6-10-16/h3-12H,1-2H3
InChI Key:
FQKPINNOUFFAKI-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)C)C=C1SSC(=CC(=O)c2ccc(cc2)C)S1
Properties
Complexity:
516
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.031g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
384.526g/mol
Monoisotopic Mass:
384.031g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
5.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.