Basic information
- CAS
92619-32-4- Standard SMILES
O=C1C2C3CCC(C3)C2C(=O)N1O- InChIKey
NQCGHVBLTCGHIY-UHFFFAOYSA-N- Molecular formula
- C9H11NO3
- Average molar mass
- 181.19 g/mol
- Monoisotopic mass
- 181.07389321
Names & identifiers
- Preferred name
- 2-hydroxyhexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
- IUPAC
- 4-hydroxy-4-azatricyclo[5.2.1.02,6]decane-3,5-dione
Names & synonyms
92619-32-42-hydroxyhexahydro-1H-4,7-methanoisoindole-1,3(2H)-dioneSTK252957Hexahydro-2-hydroxy-4,7-methano-1H-isoindole-1,3(2H)-dione4,7-Methano-1H-isoindole-1,3(2H)-dione, hexahydro-2-hydroxy-SCHEMBL7325441DTXSID40395184AKOS001672016AKOS022076818DB-393272ST50864274AN-919/15529160
Show more names
SR-01000494504SR-01000494504-14-hydroxy-4-azatricyclo[5.2.1.02,6]decane-3,5-dione4-hydroxy-4-azatricyclo[5.2.1.0<2,6>]decane-3,5-dione4-hydroxy-4-azatricyclo[5.2.1.0~2,6~]decane-3,5-dione
Database identifiers
- CAS
92619-32-4- PubChem CID
- 3696931
- DTXSID
DTXSID40395184
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 273
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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