CAS 496-74-2 Toluene-3,4-dithiol - Materials / Alfa Chemistry

NAVIGATION

Toluene-3,4-dithiol

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Catalog Number

ACM496742

CAS Number

496-74-2

Product Name

Toluene-3,4-dithiol

Structure

Category

Charge Transfer Complexes; Ligands for Functional Metal Complexes; Molecular Conductors

IUPAC Name

4-methylbenzene-1,2-dithiol

Molecular Weight

156.3g/mol

Molecular Formula

C7H8S2

Canonical SMILES

CC1=CC(=C(C=C1)S)S

InChI

InChI=1S/C7H8S2/c1-5-2-3-6(8)7(9)4-5/h2-4,8-9H,1H3

InChI Key

NIAAGQAEVGMHPM-UHFFFAOYSA-N

Melting Point

29.0 °C

Complexity

92.9

Covalently-Bonded Unit Count

EC Number

207-828-3

Exact Mass

156.006743g/mol

Formal Charge

Heavy Atom Count

MeSH Entry Terms

dithiol;toluene-3,4-dithiol

Monoisotopic Mass

156.006743g/mol

NSC Number

5391

Rotatable Bond Count

UNII

U89B11P7SC

XLogP3

2.6

MSDS

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COA

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Spec Sheet

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