Basic information
- CAS
33667-80-0- Standard SMILES
Cc1cc(C)c(Sc2ccccc2)c(C)c1- InChIKey
IOVNMGMCDITBSD-UHFFFAOYSA-N- Molecular formula
- C15H16S
- Average molar mass
- 228.4 g/mol
- Monoisotopic mass
- 228.09727151
Names & identifiers
- Preferred name
- 1,3,5-Trimethyl-2-(phenylsulfanyl)benzene
- IUPAC
- 1,3,5-trimethyl-2-phenylsulfanylbenzene
- English name
- 2,4,6-Trimethyl diphenyl sulfide
- Molecular formula
- C15H16S
- Molecular weight
- 228.35
Names & synonyms
33667-80-01,3,5-TRIMETHYL-2-(PHENYLSULFANYL)BENZENEDTXSID50495801RefChem:217474DTXCID504466112,4,6-Trimethyl diphenyl sulfide1,3,5-trimethyl-2-phenylsulfanylbenzenemesityl(phenyl)sulfane1,3,5-trimethyl-2-(phenylthio)benzene(2,4,6-trimethyl-phenyl)-phenyl sulfidePhenyl mesityl sulfideA821899
Show more names
2,4,6-Trimethyl2,4,6-TRIMETHYL DIPHMesityl phenyl sulfideTrimethyldiphenylsulfide2,4,6-TRIMETHYL DIPHENYL SULFIDE 97%MIN
SCHEMBL5887430AKOS015898772HS-5654AC-164591,3,5-trimethyl-2-phenylsulfanyl-benzene
Database identifiers
- CAS
33667-80-0- PubChem CID
- 12386992
- DTXSID
DTXSID50495801- Nikkaji
- J1.795.383D
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 195
Physicochemical properties
- Boiling point
- 115 °C · 115 °C(Press: 0.25 Torr)
- Density
- 1.075 · 1.075±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- CAS DataBase Reference
- 33667 · 33667-80-0(CAS DataBase Reference)
Chemistry & industry
Suppliers26 total
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
陕西缔都医药化工有限公司+86-029-81138252 +86-173 9270 1263 · [email protected]
郑州九亿时光新材料有限公司+86-15225627621 +86-13213167925 · [email protected]
嘉兴市德亿化工有限公司0573-85866609 13325730825 · [email protected]
山东小野化学股份有限公司0539-6362799 20）
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
浙江寿尔福化工贸易有限公司0571-88906230 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
陕西缔都医药化工有限公司
Related reactions
2 records
Compound notes
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