(2-Nitrophenyl)(2,4,6-trimethoxyphenyl)methanone
Basic information
- CAS
61736-73-0- Standard SMILES
COc1cc(OC)c(C(=O)c2ccccc2[N+](=O)[O-])c(OC)c1- InChIKey
AEBVSRZEWZJVMZ-UHFFFAOYSA-N- Molecular formula
- C16H15NO6
- Average molar mass
- 317.29 g/mol
- Monoisotopic mass
- 317.0899372
Names & identifiers
- Preferred name
- (2-Nitrophenyl)(2,4,6-trimethoxyphenyl)methanone
- IUPAC
- (2-nitrophenyl)-(2,4,6-trimethoxyphenyl)methanone
Names & synonyms
61736-73-0MLS002920575(2-nitrophenyl)(2,4,6-trimethoxyphenyl)methanone(2-nitrophenyl)-(2,4,6-trimethoxyphenyl)methanoneNSC142694DTXSID00301382NSC-142694SMR001798163DS-007740
Database identifiers
- CAS
61736-73-0- PubChem CID
- 285653
- DTXSID
DTXSID00301382
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 90.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 409
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Compound notes
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