Basic information
- CAS
101371-20-4- Standard SMILES
CCCC(C)c1ccc(C(CC)CC)cc1- InChIKey
ZMJKPBLBOSIOHA-UHFFFAOYSA-N- Molecular formula
- C16H26
- Average molar mass
- 218.38 g/mol
- Monoisotopic mass
- 218.20345083
Names & identifiers
- Preferred name
- 1-(2-Pentyl)-4-(3-pentyl)benzene
- IUPAC
- 1-pentan-2-yl-4-pentan-3-ylbenzene
- English name
- 1-(2-Pentyl)-4-(3-pentyl)benzene
- Molecular formula
- C16H26
- Molecular weight
- 218.38
Names & synonyms
101371-20-41-(2-Pentyl)-4-(3-pentyl)benzene1-(PENTAN-2-YL)-4-(PENTAN-3-YL)BENZENE4-(ethylpropyl)-1-(methylbutyl)benzeneBenzene,1-(1-ethylpropyl)-4-(1-methylbutyl)-SCHEMBL29191676DTXSID10906089SBB061351AKOS024390972ST51047373Benzene, 1-(1-ethylpropyl)-4-(1-methylbutyl)-
Database identifiers
- CAS
101371-20-4- PubChem CID
- 145368
- DTXSID
DTXSID10906089
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 161
Physicochemical properties
- Boiling point
- 283.7 · 283.7±10.0 °C(Predicted)
- Density
- 0.854 · 0.854±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…