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14173-25-2 | Disulfide, methyl phenyl
CAS No: 14173-25-2 Catalog No: AG001GY4 MDL No:
Product Description
Catalog Number:
AG001GY4
Chemical Name:
Disulfide, methyl phenyl
CAS Number:
14173-25-2
Molecular Formula:
C7H8S2
Molecular Weight:
156.2684
IUPAC Name:
(methyldisulfanyl)benzene
InChI:
InChI=1S/C7H8S2/c1-8-9-7-5-3-2-4-6-7/h2-6H,1H3
InChI Key:
LMSQHVXHZCNJEP-UHFFFAOYSA-N
SMILES:
CSSc1ccccc1
EC Number:
238-020-9
UNII:
CY4EJP36CL
FEMA Number:
3872
Properties
Complexity:
67.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.007g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.261g/mol
Monoisotopic Mass:
156.007g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Bioactive pyridine-N-oxide disulfides from Allium stipitatum. | Journal of natural products 20090327 |
| Evaluation of selected chemotypes in coupled cellular and molecular target-based screens identifies novel HIV-1 zinc finger inhibitors. | Journal of medicinal chemistry 19960913 |
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