Basic information
- CAS
4074-22-0- Standard SMILES
CC1=CCC(C)=CC1- InChIKey
SUXVTICOXXNSKI-UHFFFAOYSA-N- Molecular formula
- C8H12
- Average molar mass
- 108.18 g/mol
- Monoisotopic mass
- 108.09390038
Names & identifiers
- Preferred name
- 1,4-Cyclohexadiene, 1,4-dimethyl-
- IUPAC
- 1,4-dimethylcyclohexa-1,4-diene
- English name
- 1,4-DIMETHYL-1,4-CYCLOHEXADIENE
- Molecular formula
- C8H12
- Molecular weight
- 108.18
Names & synonyms
4074-22-01,4-Cyclohexadiene, 1,4-dimethyl-DTXSID40404604RefChem:220298DTXCID703554581,4-dimethylcyclohexa-1,4-diene1,4-Dimethyl-1,4-cycolhexadiene1,4-DIMETHYL-1,4-CYCLOHEXADIENESCHEMBL797340AKOS0062788001,4-dimethyl-cyclohexa-1,4-diene
Database identifiers
- CAS
4074-22-0- PubChem CID
- 4589179
- DTXSID
DTXSID40404604- Nikkaji
- J284.105C
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 120
Physicochemical properties
- Boiling point
- 140 · 140-142 °C
- Density
- 0.838 · 0.838±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers1 total
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…