1-(3-Methylbut-1-en-2-yl)cyclopentane-1-carbaldehyde
Basic information
- CAS
2228-95-7- Standard SMILES
C=C(C(C)C)C1(C=O)CCCC1- InChIKey
QINMOIQXMUWXQC-UHFFFAOYSA-N- Molecular formula
- C11H18O
- Average molar mass
- 166.26 g/mol
- Monoisotopic mass
- 166.13576519
Names & identifiers
- Preferred name
- 1-(3-Methylbut-1-en-2-yl)cyclopentane-1-carbaldehyde
- IUPAC
- 1-(3-methylbut-1-en-2-yl)cyclopentane-1-carbaldehyde
Names & synonyms
2228-95-71-(3-methylbut-1-en-2-yl)cyclopentane-1-carbaldehydeDTXSID00725064RefChem:224513DTXCID10675809
Database identifiers
- CAS
2228-95-7- PubChem CID
- 57375910
- DTXSID
DTXSID00725064
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 185
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationCyclopentanecarboxaldehyde, 1-(1,1-dimethyl-2-propenyl)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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