Basic information
- CAS
6108-96-9- Standard SMILES
C=C(C)C/C=C/C- InChIKey
XBUBWPOBEDQVOO-SNAWJCMRSA-N- Molecular formula
- C7H12
- Average molar mass
- 96.17 g/mol
- Monoisotopic mass
- 96.09390038
Names & identifiers
- Preferred name
- (4E)-2-methylhexa-1,4-diene
- IUPAC
- (4E)-2-methylhexa-1,4-diene
Names & synonyms
(4E)-2-methylhexa-1,4-diene6108-96-9DTXSID901015950RefChem:1050475DTXCID0014741072-Methyl-1,4-hexadiene1,4-Hexadiene, 2-methyl-SCHEMBL736046SCHEMBL3460455(4E)-2-Methyl-1,4-hexadieneXBUBWPOBEDQVOO-SNAWJCMRSA-N(4E)-2-Methyl-1,4-hexadiene #
Show more names
DB-235127
Database identifiers
- CAS
6108-96-9- PubChem CID
- 5367524
- DTXSID
DTXSID901015950- Nikkaji
- J102.038B
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 78
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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