1-(3-Methylphenyl)-4-methyl-3-pentene
Basic information
- CAS
51082-26-9- Standard SMILES
CC(C)=CCCc1cccc(C)c1- InChIKey
MMRSOIRVYUDAHI-UHFFFAOYSA-N- Molecular formula
- C13H18
- Average molar mass
- 174.28 g/mol
- Monoisotopic mass
- 174.14085057
Names & identifiers
- Preferred name
- 1-(3-Methylphenyl)-4-methyl-3-pentene
- IUPAC
- 1-methyl-3-(4-methylpent-3-enyl)benzene
- English name
- 1-(3-Methylphenyl)-4-methyl-3-pentene
- Molecular formula
- C13H18
- Molecular weight
- 174.28
Names & synonyms
1-(3-METHYLPHENYL)-4-METHYL-3-PENTENE51082-26-9DTXSID30341014RefChem:224539DTXCID102920951-(3-Methylphenyl)4-methyl-3-penteneMMRSOIRVYUDAHI-UHFFFAOYSA-NAKOS0062738221-Methyl-3-(4-methyl-3-pentenyl)benzene #1-Methyl-3-(4-methylpent-3-en-1-yl)benzeneBenzene, 1-methyl-3-(4-methyl-3-penten-1-yl)-
Database identifiers
- CAS
51082-26-9- PubChem CID
- 569285
- DTXSID
DTXSID30341014
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 163
Physicochemical properties
- Boiling point
- 242.8 · 242.8±15.0 °C(Predicted)
- Density
- 0.88 · 0.880±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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