Basic information
- CAS
13828-31-4- Standard SMILES
CC1=CC(C(C)C)CCC1- InChIKey
MLMLOMRVLOMMDG-UHFFFAOYSA-N- Molecular formula
- C10H18
- Average molar mass
- 138.25 g/mol
- Monoisotopic mass
- 138.14085057
Names & identifiers
- Preferred name
- m-Menth-1-ene
- IUPAC
- 1-methyl-3-propan-2-ylcyclohexene
- English name
- 1-Methyl-3-(1-methylethyl)cyclohexene
- Molecular formula
- C10H18
- Molecular weight
- 138.25
Names & synonyms
m-Menth-1-enem-Menthene7PHF4CJO0FUNII-7PHF4CJO0FCyclohexene, 5-methyl-1-(1-methylethyl)-Cyclohexene, 1-methyl-3-(1-methylethyl)-DTXSID50340569RefChem:201540DTXCID20291650MLMLOMRVLOMMDG-UHFFFAOYSA-N13828-31-41-methyl-3-propan-2-ylcyclohexene
Show more names
1-Methyl-3-(1-methylethyl)cyclohexene1-Methyl-3-(propan-2-yl)cyclohex-1-eneSCHEMBL217589743-Isopropyl-1-methyl-1-cyclohexene #1-methyl-3-(1-methyl ethyl)-cyclohexene
Database identifiers
- CAS
13828-31-4- PubChem CID
- 565688
- DTXSID
DTXSID50340569- UNII
- 7PHF4CJO0F
- Nikkaji
- J109.976K
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 131
Physicochemical properties
- Boiling point
- 162 · 162-163 °C
- Density
- 0.8232 g/cm3 · 0.8232 g/cm3
- FDA UNII
- 7 PHF4CJO0F · 7PHF4CJO0F
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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