Basic information
- Standard SMILES
CC(=C(Cl)Cl)c1ccc(N)c([N+](=O)[O-])c1- InChIKey
ZQZXLFGCRSXANQ-UHFFFAOYSA-N- Molecular formula
- C9H8Cl2N2O2
- Average molar mass
- 247.07 g/mol
Names & identifiers
- Preferred name
- 1-Amino 2-nitro-4-(2,2-dichloro-1-methylethenyl) benzene
- IUPAC
- 4-(1,1-dichloroprop-1-en-2-yl)-2-nitroaniline
Names & synonyms
SCHEMBL11430055ZQZXLFGCRSXANQ-UHFFFAOYSA-N1-amino 2-nitro-4-(2,2-dichloro-1-methylethenyl) benzene
Database identifiers
- PubChem CID
- 21392432
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 71.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 284
Related reactions
2 records
Compound notes
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