Basic information
- CAS
176956-56-2- Standard SMILES
N#CC1(CO)OC12CCCC2- InChIKey
YSJWVGFHUBLRIO-UHFFFAOYSA-N- Molecular formula
- C8H11NO2
- Average molar mass
- 153.18 g/mol
Names & identifiers
- Preferred name
- 2-(Hydroxymethyl)-1-oxaspiro[2.4]heptane-2-carbonitrile
- IUPAC
- 2-(hydroxymethyl)-1-oxaspiro[2.4]heptane-2-carbonitrile
- English name
- 1-Oxaspiro[2.4]heptane-2-carbonitrile,2-(hydroxymethyl)-(9CI)
- Molecular formula
- C8H11NO2
- Molecular weight
- 153.17844
Names & synonyms
176956-56-22-(hydroxymethyl)-1-oxaspiro[2.4]heptane-2-carbonitrile1-Oxaspiro[2.4]heptane-2-carbonitrile,2-(hydroxymethyl)-(9CI)
Database identifiers
- CAS
176956-56-2
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 56.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 223
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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