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102231-97-0 | 1,2-Benzenedicarbonitrile, 3,4,5,6-tetrakis(ethylthio)-
CAS No: 102231-97-0 Catalog No: AG0006ZE MDL No:
Product Description
Catalog Number:
AG0006ZE
Chemical Name:
1,2-Benzenedicarbonitrile, 3,4,5,6-tetrakis(ethylthio)-
CAS Number:
102231-97-0
Molecular Formula:
C16H20N2S4
Molecular Weight:
368.6034
IUPAC Name:
3,4,5,6-tetrakis(ethylsulfanyl)benzene-1,2-dicarbonitrile
InChI:
InChI=1S/C16H20N2S4/c1-5-19-13-11(9-17)12(10-18)14(20-6-2)16(22-8-4)15(13)21-7-3/h5-8H2,1-4H3
InChI Key:
VCZRHRAFZUCKLY-UHFFFAOYSA-N
SMILES:
CCSc1c(SCC)c(SCC)c(c(c1SCC)C#N)C#N
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.051g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.59g/mol
Monoisotopic Mass:
368.051g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
149A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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