Basic information
- CAS
52962-99-9- Standard SMILES
COCC1[C@@H]2C=C[C@H]1CC2=O- InChIKey
FAQMUJPTADIXNH-WPZUCAASSA-N- Molecular formula
- C9H12O2
- Average molar mass
- 152.19 g/mol
- Monoisotopic mass
- 152.08372962
Names & identifiers
- Preferred name
- 7-Syn-methoxymethylnorborn-5-en-2-one
- IUPAC
- (1S,4R)-7-(methoxymethyl)bicyclo[2.2.1]hept-5-en-2-one
Names & synonyms
52962-99-9EINECS 258-281-27-Syn-methoxymethylnorborn-5-en-2-one7-(methoxymethyl)bicyclo[2.2.1]hept-5-en-2-oneSCHEMBL11838133DTXSID50967432NS00056798(1S,4R)-7-(METHOXYMETHYL)BICYCLO[2.2.1]HEPT-5-EN-2-ONE
Database identifiers
- CAS
52962-99-9- PubChem CID
- 104372
- DTXSID
DTXSID50967432- EC Number
- 258-281-2
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 208
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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