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141858-23-3 | Phosphine, bis[2-(1,3-dithiol-2-ylidene)-1,3-dithiol-4-yl]phenyl-
CAS No: 141858-23-3 Catalog No: AG001H99 MDL No:
Product Description
Catalog Number:
AG001H99
Chemical Name:
Phosphine, bis[2-(1,3-dithiol-2-ylidene)-1,3-dithiol-4-yl]phenyl-
CAS Number:
141858-23-3
Molecular Formula:
C18H11PS8
Molecular Weight:
514.7737
IUPAC Name:
bis[2-(1,3-dithiol-2-ylidene)-1,3-dithiol-4-yl]-phenylphosphane
InChI:
InChI=1S/C18H11PS8/c1-2-4-12(5-3-1)19(13-10-24-17(26-13)15-20-6-7-21-15)14-11-25-18(27-14)16-22-8-9-23-16/h1-11H
InChI Key:
RUPKDOTUPNIYRP-UHFFFAOYSA-N
SMILES:
C1=CSC(=C2SC=C(S2)P(c2ccccc2)C2=CSC(=C3SC=CS3)S2)S1
Properties
Complexity:
722
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
513.836g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
514.74g/mol
Monoisotopic Mass:
513.836g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
202A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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