1,2-Pentadiene, 3-(1,1-dimethylethyl)-4,4-dimethyl-
Basic information
- CAS
22585-31-5- Standard SMILES
C=C=C(C(C)(C)C)C(C)(C)C- InChIKey
CMFCUMMNLOPFCC-UHFFFAOYSA-N- Molecular formula
- C11H20
- Average molar mass
- 152.28 g/mol
- Monoisotopic mass
- 152.15650064
Names & identifiers
- Preferred name
- 1,2-Pentadiene, 3-(1,1-dimethylethyl)-4,4-dimethyl-
- IUPAC
- 3-tert-butyl-4,4-dimethylpenta-1,2-diene
Names & synonyms
1,2-Pentadiene, 3-(1,1-dimethylethyl)-4,4-dimethyl-22585-31-5DTXSID70177112RefChem:216408DTXCID0099603(tert-C4H9)2C=C=CH23-tert-butyl-4,4-dimethylpenta-1,2-diene
Database identifiers
- CAS
22585-31-5- PubChem CID
- 140940
- DTXSID
DTXSID70177112
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 161
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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