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86199-22-6 | Benzene, 1,4-bis(ethenylthio)-
CAS No: 86199-22-6 Catalog No: AG004SQL MDL No:
Product Description
Catalog Number:
AG004SQL
Chemical Name:
Benzene, 1,4-bis(ethenylthio)-
CAS Number:
86199-22-6
Molecular Formula:
C10H10S2
Molecular Weight:
194.3164
IUPAC Name:
1,4-bis(ethenylsulfanyl)benzene
InChI:
InChI=1S/C10H10S2/c1-3-11-9-5-7-10(8-6-9)12-4-2/h3-8H,1-2H2
InChI Key:
HJPPBGGCSFEJBU-UHFFFAOYSA-N
SMILES:
C=CSc1ccc(cc1)SC=C
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.022g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.31g/mol
Monoisotopic Mass:
194.022g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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