Basic information
- CAS
65087-04-9- Standard SMILES
Cc1ccc(SSc2c(C)cccc2C)c(C)c1- InChIKey
BMOJFIQTZGTZOA-UHFFFAOYSA-N- Molecular formula
- C16H18S2
- Average molar mass
- 274.4 g/mol
- Monoisotopic mass
- 274.08499292
Names & identifiers
- Preferred name
- 2,4-Xylyl 2,6-xylyl disulfide
- IUPAC
- 1-[(2,6-dimethylphenyl)disulfanyl]-2,4-dimethylbenzene
- English name
- 2,4-xylyl 2,6-xylyl disulphide
- Molecular formula
- C16H18S2
- Molecular weight
- 274.44
Names & synonyms
Disulfide, 2,4-xylyl 2,6-xylyl65087-04-92,4-Xylyl 2,6-xylyl disulfideDisulfide, 2,4-dimethylphenyl 2,6-dimethylphenyl8923ZCR8NJEINECS 265-393-5DTXSID6070196RefChem:443997DTXCID3044467UNII-8923ZCR8NJSCHEMBL28098549BMOJFIQTZGTZOA-UHFFFAOYSA-N
Show more names
2,4-Dimethylphenyl(2,6-dimethylphenyl) persulfide
2,4-Xylyl 2,6-xylyl disulphideNS00035793Q278964572-[(2,4-DIMETHYLPHENYL)DISULFANYL]-1,3-DIMETHYLBENZENE
Database identifiers
- CAS
65087-04-9- PubChem CID
- 103161
- DTXSID
DTXSID6070196- UNII
- 8923ZCR8NJ
- EC Number
- 265-393-5
- Nikkaji
- J286.657I
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
- 8923 ZCR8NJ · 8923ZCR8NJ
- EPA Substance Registry System
- 2 · Disulfide, 2,4-dimethylphenyl 2,6-dimethylphenyl (65087-04-9)
- 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 2,6-dimethylphenyl: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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