4,5-Bis(mercaptomethyl)-o-xylene

CAS
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CAS
10230-61-2
Size
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Purity
96.0%(GC)(T)
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Catalog Number

ACM-MO-10230612

Product Name

4,5-Bis(mercaptomethyl)-o-xylene

Structure

CAS

10230-61-2

Category

Heterocyclic Organic Compound

Synonyms

1,2-Dimethyl-4,5-bis(mercaptomethyl)benzene;
4,5-Dimethyl-o-xylylenedithiol;
Durene-α1,α2-dithiol

IUPAC Name

[4,5-dimethyl-2-(sulfanylmethyl)phenyl]methanethiol

Molecular Weight

198.34 g/mol

Molecular Formula

C10H14S2

Canonical SMILES

CC1=CC(=C(C=C1C)CS)CS

InChI

InChI=1S/C10H14S2/c1-7-3-9(5-11)10(6-12)4-8(7)2/h3-4,11-12H,5-6H2,1-2H3

InChI Key

NNGQXIUDFKIVKI-UHFFFAOYSA-N

Melting Point

69 °C

Solubility

Soluble in chloroform.

Appearance

White to Almost White Powder to Crystal

Complexity

120

Covalently-Bonded Unit Count

EC Number

233-551-2

Exact Mass

198.053693g/mol

Formal Charge

H-Bond Acceptor

H-Bond Donor

Heavy Atom Count

Monoisotopic Mass

198.053693g/mol

NSC Number

169963

Physical State

Solid

Rotatable Bond Count

UNII

KYL78P7L21

XLogP3

2.8

MSDS

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COA

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Spec Sheet

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