Basic information
- CAS
60702-14-9- Standard SMILES
CCC(Sc1ccccc1)c1ccc(OC)cc1- InChIKey
VAOHUBSIMCYUFT-UHFFFAOYSA-N- Molecular formula
- C16H18OS
- Average molar mass
- 258.4 g/mol
- Monoisotopic mass
- 258.10783637
Names & identifiers
- Preferred name
- Benzene, 1-methoxy-4-(1-(phenylthio)propyl)-
- IUPAC
- 1-methoxy-4-(1-phenylsulfanylpropyl)benzene
- English name
- 1-Methoxy-4-[1-(phenylthio)propyl]benzene
- Molecular formula
- C16H18OS
- Molecular weight
- 258.38
Names & synonyms
60702-14-91-(4-Methoxyphenyl)-1-phenylthiopropaneBRN 1882286Anisole, p-(1-(phenylthio)propyl)-Propane, 1-(4-methoxyphenyl)-1-phenylthio-Benzene, 1-methoxy-4-(1-(phenylthio)propyl)-RefChem:3237871-METHOXY-4-[1-(PHENYLSULFANYL)PROPYL]BENZENEDTXSID40976139DB-2914741-Methoxy-4-[1-(phenylthio)propyl ]benzene1-Methoxy-4-[1-(phenylthio)propyl]benzene
Show more names
Benzene, 1-methoxy-4-[1-(phenylthio)propyl]-
Database identifiers
- CAS
60702-14-9- PubChem CID
- 3045429
- DTXSID
DTXSID40976139- Nikkaji
- J149.302G
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 34.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 217
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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