N-[3-nitro-4-(3-phenylpropoxy)phenyl]acetamide
Basic information
- CAS
19160-04-4- Standard SMILES
CC(=O)Nc1ccc(OCCCc2ccccc2)c([N+](=O)[O-])c1- InChIKey
IOWXRVUKIRUWSO-UHFFFAOYSA-N- Molecular formula
- C17H18N2O4
- Average molar mass
- 314.34 g/mol
- Monoisotopic mass
- 314.12665706
Names & identifiers
- Preferred name
- N-[3-nitro-4-(3-phenylpropoxy)phenyl]acetamide
- IUPAC
- N-[3-nitro-4-(3-phenylpropoxy)phenyl]acetamide
Names & synonyms
19160-04-4N-[3-nitro-4-(3-phenylpropoxy)phenyl]acetamideNSC212445DTXSID00309646NSC-212445
Database identifiers
- CAS
19160-04-4- PubChem CID
- 309980
- DTXSID
DTXSID00309646
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 391
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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