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Basic information
- CAS
860466-30-4- Standard SMILES
COCCNc1c(OC)cccc1[N+](=O)[O-]- InChIKey
DUBVQXHJIXJEFG-UHFFFAOYSA-N- Molecular formula
- C10H14N2O4
- Average molar mass
- 226.23 g/mol
- Monoisotopic mass
- 226.09535693
Names & identifiers
- Preferred name
- (2-Methoxy-ethyl)-(2-methoxy-6-nitro-phenyl)-amine
- IUPAC
- 2-methoxy-N-(2-methoxyethyl)-6-nitroaniline
Names & synonyms
(2-Methoxy-ethyl)-(2-methoxy-6-nitro-phenyl)-amineSCHEMBL2498853DUBVQXHJIXJEFG-UHFFFAOYSA-NDTXSID201241960860466-30-42-methoxy-N-(2-methoxyethyl)-6-nitroaniline2-Methoxy-N-(2-methoxyethyl)-6-nitrobenzenamine
Database identifiers
- CAS
860466-30-4- PubChem CID
- 57772036
- DTXSID
DTXSID201241960
Properties
Computed structural propertiesFilling in
- XLogP
- 2.1
- Topological polar surface area
- 76.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 219
Related reactions
3 records
Compound notes
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