Basic information
- Standard SMILES
COc1ccc2c(c1[N+](=O)[O-])CCCC2=O- InChIKey
KVJWCFCHDPZOQF-UHFFFAOYSA-N- Molecular formula
- C11H11NO4
- Average molar mass
- 221.21 g/mol
Names & identifiers
- Preferred name
- 6-Methoxy-5-nitro-1,2,3,4-tetrahydronaphthalen-1-one
- IUPAC
- 6-methoxy-5-nitro-3,4-dihydro-2H-naphthalen-1-one
Names & synonyms
65472-72-26-methoxy-5-nitro-1,2,3,4-tetrahydronaphthalen-1-oneSCHEMBL51883226-Methoxy-5-nitro-1-tetraloneKVJWCFCHDPZOQF-UHFFFAOYSA-NDB-182982EN300-67363743,4-Dihydro-6-methoxy-5-nitro-1(2h)-naphthalenone6-methoxy-5-nitro-3,4-dihydro-1(2H)-naphthalenoneZ2050007236
Database identifiers
- PubChem CID
- 13067337
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 299
Related reactions
7 records
Compound notes
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