1-Phenylsulfanyl-2-(phenylsulfanylmethyl)undecan-2-ol

Substructure search Find similar structures

Basic information

CAS: 37643-42-8
Standard SMILES: CCCCCCCCCC(O)(CSc1ccccc1)CSc1ccccc1
InChIKey: RPMWJJDFMWQTEV-UHFFFAOYSA-N
Molecular formula: C24H34OS2
Average molar mass: 402.7 g/mol
Monoisotopic mass: 402.20510805

Names & identifiers

Preferred name: 1-Phenylsulfanyl-2-(phenylsulfanylmethyl)undecan-2-ol
IUPAC: 1-phenylsulfanyl-2-(phenylsulfanylmethyl)undecan-2-ol

Names & synonyms

37643-42-81-phenylsulfanyl-2-(phenylsulfanylmethyl)undecan-2-olNSC311955DTXSID30317153NSC-3119551-(Phenylsulfanyl)-2-[(phenylsulfanyl)methyl]undecan-2-ol

Database identifiers

CAS: 37643-42-8
PubChem CID: 329405
DTXSID: DTXSID30317153

Properties

Computed structural properties

XLogP: 8.3
Topological polar surface area: 70.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 14
Heavy atoms: 27
Formal charge: 0
Complexity: 326

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…