Spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-carboxaldehyde
Basic information
- CAS
63124-56-1- Standard SMILES
O=Cc1ccc2c(c1)OC1(CCCC1)O2- InChIKey
VFFDHJZSWIZHNO-UHFFFAOYSA-N- Molecular formula
- C12H12O3
- Average molar mass
- 204.22 g/mol
- Monoisotopic mass
- 204.07864424
Names & identifiers
- Preferred name
- Spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-carboxaldehyde
- IUPAC
- spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-carbaldehyde
Names & synonyms
63124-56-1Spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-carboxaldehydeDTXSID90344925Spiro(1,3-benzodioxole-2,1'-cyclopentane)-5-carboxaldehydeRefChem:380816DTXCID802960002,2-Tetramethylene-5-formyl-1,3-benzodioxoleVFFDHJZSWIZHNO-UHFFFAOYSA-NSpiro[[1,3]benzodioxole-2,1'-cyclopentane]-5-carbaldehyde
Database identifiers
- CAS
63124-56-1- PubChem CID
- 600401
- DTXSID
DTXSID90344925
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 258
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Related reactions
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Compound notes
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