Basic information
- CAS
15024-11-0- Standard SMILES
Cc1ccc(OC(=O)c2ccc([N+](=O)[O-])cc2)cc1- InChIKey
VXCLPVZGTDMDND-UHFFFAOYSA-N- Molecular formula
- C14H11NO4
- Average molar mass
- 257.24 g/mol
- Monoisotopic mass
- 257.06880783
Names & identifiers
- Preferred name
- 4-Methylphenyl 4-nitrobenzoate
- IUPAC
- (4-methylphenyl) 4-nitrobenzoate
Names & synonyms
4-methylphenyl 4-nitrobenzoate15024-11-0DTXSID40324075RefChem:294643DTXCID20275192NSC405663p-tolyl 4-nitrobenzoateOprea1_164414Oprea1_695561SCHEMBL5696807AKOS000746693NSC-405663
Show more names
EU-0034240ST50222581SR-01000395501SR-01000395501-1
Database identifiers
- CAS
15024-11-0- PubChem CID
- 347154
- DTXSID
DTXSID40324075- Nikkaji
- J3.465.353D
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 323
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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