Benzene, 1,1'-(2-nitrobutylidene)bis(4-methoxy-
Basic information
- CAS
85078-20-2- Standard SMILES
CCC(C(c1ccc(OC)cc1)c1ccc(OC)cc1)[N+](=O)[O-]- InChIKey
GKZZKRSVMNROBJ-UHFFFAOYSA-N- Molecular formula
- C18H21NO4
- Average molar mass
- 315.4 g/mol
- Monoisotopic mass
- 315.14705815
Names & identifiers
- Preferred name
- Benzene, 1,1'-(2-nitrobutylidene)bis(4-methoxy-
- IUPAC
- 1-methoxy-4-[1-(4-methoxyphenyl)-2-nitrobutyl]benzene
Names & synonyms
85078-20-21,1'-(2-nitrobutane-1,1-diyl)bis(4-methoxybenzene)Benzene, 1,1'-(2-nitrobutylidene)bis(4-methoxy-DTXSID008750581,1-DI(P-MEO PHENYL)-2-NITROBUTANE
Database identifiers
- CAS
85078-20-2- PubChem CID
- 94689
- DTXSID
DTXSID00875058
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 331
Experimental & physicochemical properties
LogP4.45
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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