5-Heptenal, 2,2,6-trimethyl-
Completing data — refresh the page later to see the latest
Basic information
- CAS
52279-00-2- Standard SMILES
CC(C)=CCCC(C)(C)C=O- InChIKey
IHUYETNQLCGWSV-UHFFFAOYSA-N- Molecular formula
- C10H18O
- Average molar mass
- 154.25 g/mol
- Monoisotopic mass
- 154.13576519
Names & identifiers
- Preferred name
- 5-Heptenal, 2,2,6-trimethyl-
- IUPAC
- 2,2,6-trimethylhept-5-enal
- English name
- 2,2,6-trimethylhept-5-enal
- Molecular formula
- C10H18O
- Molecular weight
- 154.25
Names & synonyms
52279-00-25-Heptenal, 2,2,6-trimethyl-2,2,6-Trimethyl-5-heptenalEINECS 257-809-9DTXSID5068730RefChem:102702DTXCID80411612,2,6-Trimethylhept-5-enalEJ3S25TG9HIHUYETNQLCGWSV-UHFFFAOYSA-NDB-302049NS00032470
Show more names
4-(Bis(3-methylbut-2-en-1-yl)amino)-2-(naphthalen-1-yl)butanamide
EN300-1622166
Database identifiers
- CAS
52279-00-2- PubChem CID
- 104140
- DTXSID
DTXSID5068730- UNII
- EJ3S25TG9H
- EC Number
- 257-809-9
- Nikkaji
- J295.625J
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 150
Physicochemical properties
- EPA Substance Registry System
- 5 · 5-Heptenal, 2,2,6-trimethyl- (52279-00-2)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information5-Heptenal, 2,2,6-trimethyl-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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