3-Pentan-3-ylsulfanylpentane
Basic information
- CAS
5414-98-2- Standard SMILES
CCC(CC)SC(CC)CC- InChIKey
RFAWIPKYLMDDTM-UHFFFAOYSA-N- Molecular formula
- C10H22S
- Average molar mass
- 174.35 g/mol
- Monoisotopic mass
- 174.14422188
Names & identifiers
- Preferred name
- 3-Pentan-3-ylsulfanylpentane
- IUPAC
- 3-pentan-3-ylsulfanylpentane
Names & synonyms
5414-98-23-pentan-3-ylsulfanylpentaneNSC11007Pentane, 3,3'-thiobis-SCHEMBL776181DTXSID10279003RFAWIPKYLMDDTM-UHFFFAOYSA-N3-[(Pentan-3-yl)sulfanyl]pentaneNSC-11007
Database identifiers
- CAS
5414-98-2- PubChem CID
- 223385
- DTXSID
DTXSID10279003- Nikkaji
- J379.525J
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 62.9
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…