Basic information
- CAS
62418-91-1- Standard SMILES
C=CCSC(C)(SC)C(C)C=C- InChIKey
AEQNGWHDXSAZKI-UHFFFAOYSA-N- Molecular formula
- C10H18S2
- Average molar mass
- 202.4 g/mol
- Monoisotopic mass
- 202.08499292
Names & identifiers
- Preferred name
- 3-Methyl-4-(methylsulfanyl)-4-[(prop-2-en-1-yl)sulfanyl]pent-1-ene
- IUPAC
- 3-methyl-4-methylsulfanyl-4-prop-2-enylsulfanylpent-1-ene
Names & synonyms
62418-91-1DTXSID404965293-Methyl-4-(methylsulfanyl)-4-[(prop-2-en-1-yl)sulfanyl]pent-1-ene
Database identifiers
- CAS
62418-91-1- PubChem CID
- 12401992
- DTXSID
DTXSID40496529
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 154
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…