Basic information
- CAS
20965-36-0- Standard SMILES
c1ccc(SC2CCCCO2)cc1- InChIKey
LWSNXIJOBNOGDX-UHFFFAOYSA-N- Molecular formula
- C11H14OS
- Average molar mass
- 194.3 g/mol
- Monoisotopic mass
- 194.07653624
Names & identifiers
- Preferred name
- Tetrahydro-2-(phenylthio)-2H-pyran
- IUPAC
- 2-phenylsulfanyloxane
- English name
- tetrahydro-2-(phenylthio)-2H-pyran
- Molecular formula
- C11H14OS
- Molecular weight
- 194.29
Names & synonyms
20965-36-0Tetrahydro-2-(phenylthio)-2H-pyranEINECS 244-129-2RefChem:188616244-129-2NSC6250432-(PHENYLTHIO)TETRAHYDROPYRAN2-(Phenylthio)tetrahydro-2H-pyran2-(PHENYLSULFANYL)OXANE2-phenylsulfanyltetrahydropyranSCHEMBL17397004DTXSID50943256
Show more names
2H-Pyran, tetrahydro-2-(phenylthio)-Tetrahydro-2H-pyran-2-ylphenyl sulfidePhenyl(tetrahydro-2H-pyran-2-yl) sulfide
LWSNXIJOBNOGDX-UHFFFAOYSA-NAKOS024324817NSC-625043Phenyl tetrahydro-2H-pyran-2-yl sulfideDB-321730NS00052125
Database identifiers
- CAS
20965-36-0- PubChem CID
- 89408
- DTXSID
DTXSID50943256- EC Number
- 244-129-2
- Nikkaji
- J225.368B
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 34.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 143
Chemistry & industry
Suppliers2 total
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
江苏新素新材料有限公司0512-66387919 15251950002 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…