Basic information
- Standard SMILES
COC(OC)c1cc(Cl)ccc1[N+](=O)[O-]- InChIKey
IAUJGFVKHWXBFX-UHFFFAOYSA-N- Molecular formula
- C9H10ClNO4
- Average molar mass
- 231.63 g/mol
- Monoisotopic mass
- 231.0298355
Names & identifiers
- Preferred name
- 4-Chloro-2-(dimethoxymethyl)-1-nitrobenzene
- IUPAC
- 4-chloro-2-(dimethoxymethyl)-1-nitrobenzene
Names & synonyms
2-nitro-5-chlorobenzaldehyde dimethyl acetal4-chloro-2-(dimethoxymethyl)-1-nitrobenzene13796-06-0SCHEMBL2928829IAUJGFVKHWXBFX-UHFFFAOYSA-N4-chloro-2-dimethoxymethyl-1-nitrobenzene4-Chloro-2-dimethoxymethyl-1-nitro-benzene5-chloro-2-nitrobenzaldehyde dimethylacetal5-chloro-2-nitro-benzaldehyde dimethylacetal
Database identifiers
- PubChem CID
- 3570093
- Nikkaji
- J195.877A
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 217
Related reactions
59 records
Compound notes
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