CAS
10193-95-0 Purity
95.0%(GC)(T)
10193-95-0 Purity
95.0%(GC)(T)
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4,5-Bis(mercaptomethyl)-o-xylene
CAS
10230-61-2
Catalog Number
ACM-MO-10230612
Category
Other Products; Dithiol Monomers
Molecular Weight
198.34 g/mol
Molecular Formula
C10H14S2
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Specification
Synonyms
1,2-Dimethyl-4,5-bis(mercaptomethyl)benzene;
4,5-Dimethyl-o-xylylenedithiol;
Durene-α1,α2-dithiol
4,5-Dimethyl-o-xylylenedithiol;
Durene-α1,α2-dithiol
IUPAC Name
[4,5-dimethyl-2-(sulfanylmethyl)phenyl]methanethiol
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
1
EC Number
233-551-2
Exact Mass
198.053693g/mol
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
2
Heavy Atom Count
12
Monoisotopic Mass
198.053693g/mol
NSC Number
169963
Physical State
Solid
Rotatable Bond Count
2
UNII
KYL78P7L21
XLogP3
2.8
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