1-(2,4-Dinitrophenoxy)-2-methoxy-4-(prop-2-en-1-yl)benzene
Basic information
- CAS
7508-74-9- Standard SMILES
C=CCc1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(OC)c1- InChIKey
PWFZXRVPWWSQCQ-UHFFFAOYSA-N- Molecular formula
- C16H14N2O6
- Average molar mass
- 330.29 g/mol
- Monoisotopic mass
- 330.08518617
Names & identifiers
- Preferred name
- 1-(2,4-Dinitrophenoxy)-2-methoxy-4-(prop-2-en-1-yl)benzene
- IUPAC
- 1-(2,4-dinitrophenoxy)-2-methoxy-4-prop-2-enylbenzene
Names & synonyms
7508-74-9DTXSID402822221-(2,4-dinitrophenoxy)-2-methoxy-4-(prop-2-en-1-yl)benzeneRefChem:222896DTXCID00233376NSC25021NSC-25021NSC404179NSC-404179
Database identifiers
- CAS
7508-74-9- PubChem CID
- 230313
- DTXSID
DTXSID40282222
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 460
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Compound notes
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