1-Nitro-4-(4-phenoxybutoxy)benzene
Basic information
- CAS
21278-55-7- Standard SMILES
O=[N+]([O-])c1ccc(OCCCCOc2ccccc2)cc1- InChIKey
AVOSADBWMXBHGB-UHFFFAOYSA-N- Molecular formula
- C16H17NO4
- Average molar mass
- 287.31 g/mol
- Monoisotopic mass
- 287.11575802
Names & identifiers
- Preferred name
- 1-Nitro-4-(4-phenoxybutoxy)benzene
- IUPAC
- 1-nitro-4-(4-phenoxybutoxy)benzene
Names & synonyms
1-Nitro-4-(4-phenoxybutoxy)benzene21278-55-7DTXSID40309105RefChem:232434DTXCID30260231NSC211130SCHEMBL28180985AVOSADBWMXBHGB-UHFFFAOYSA-N4-[p-Nitrophenoxy]-1-phenoxybutaneNSC-2111301-Nitro-4-(4-phenoxybutoxy)benzene #
Database identifiers
- CAS
21278-55-7- PubChem CID
- 308995
- DTXSID
DTXSID40309105
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 291
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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