Basic information
- CAS
3404-79-3- Standard SMILES
CC=C(C)CC(C)C- InChIKey
BQAZYKYBFAMHPG-UHFFFAOYSA-N- Molecular formula
- C8H16
- Average molar mass
- 112.21 g/mol
- Monoisotopic mass
- 112.12520051
Names & identifiers
- Preferred name
- 3,5-Dimethylhex-2-ene
- IUPAC
- 3,5-dimethylhex-2-ene
Names & synonyms
3,5-Dimethylhex-2-eneDTXSID10334424RefChem:271956DTXCID202855142,4-dimethyl-4-hexeneSCHEMBL3549336SCHEMBL6949992SCHEMBL8185325SCHEMBL8873507SCHEMBL28917993NS00096309
Database identifiers
- CAS
3404-79-3- PubChem CID
- 520669
- DTXSID
DTXSID10334424
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 78
Experimental & physicochemical properties
SpringerMaterials PropertiesDiamagnetic susceptibility
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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