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2,4-Xylyl 3,5-xylyl disulfide

HCID 103182
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Basic information

CAS
65104-30-5
Standard SMILES
Cc1cc(C)cc(SSc2ccc(C)cc2C)c1
InChIKey
ODOGSCCHVYNOSE-UHFFFAOYSA-N
Molecular formula
C16H18S2
Average molar mass
274.4 g/mol
Monoisotopic mass
274.08499292

Names & identifiers

Preferred name
2,4-Xylyl 3,5-xylyl disulfide
IUPAC
1-[(2,4-dimethylphenyl)disulfanyl]-3,5-dimethylbenzene
English name
2,4-xylyl 3,5-xylyl disulphide
Molecular formula
C16H18S2
Molecular weight
274.44

Names & synonyms

2,4-Xylyl 3,5-xylyl disulfide65104-30-5Disulfide, 2,4-xylyl 3,5-xylylDisulfide, 2,4-dimethylphenyl 3,5-dimethylphenyl4K4BDU939VEINECS 265-411-1DTXSID8070207RefChem:443998DTXCID7044479UNII-4K4BDU939V1-[(3,5-dimethylphenyl)disulfanyl]-2,4-dimethylbenzeneODOGSCCHVYNOSE-UHFFFAOYSA-N
Show more names
2,4-Dimethylphenyl(3,5-dimethylphenyl) persulfide
2,4-Xylyl 3,5-xylyl disulphideNS00035802Q27896706

Database identifiers

CAS
65104-30-5
PubChem CID
103182
DTXSID
DTXSID8070207
UNII
4K4BDU939V
EC Number
265-411-1
Nikkaji
J286.668D

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
50.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
18
Formal charge
0
Complexity
243

Physicochemical properties

FDA UNII
4 K4BDU939V · 4K4BDU939V
EPA Substance Registry System
2 · Disulfide, 2,4-dimethylphenyl 3,5-dimethylphenyl (65104-30-5)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationDisulfide, 2,4-dimethylphenyl 3,5-dimethylphenyl: INACTIVE

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Compound notes

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