N,N-Diethyl-2-nitroaniline
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Basic information
- CAS
2216-17-3- Standard SMILES
CCN(CC)c1ccccc1[N+](=O)[O-]- InChIKey
BUBRUAQVAPTGHV-UHFFFAOYSA-N- Molecular formula
- C10H14N2O2
- Average molar mass
- 194.23 g/mol
- Monoisotopic mass
- 194.10552769
Names & identifiers
- Preferred name
- N,N-Diethyl-2-nitroaniline
- IUPAC
- N,N-diethyl-2-nitroaniline
- English name
- N,N-DIETHYL-O-NITROANILINE
- Molecular formula
- C10H14N2O2
- Molecular weight
- 194.23
Names & synonyms
N,N-Diethyl-2-nitroanilineN,N-Diethyl-O-nitroaniline2216-17-3MFCD01120260nitrodiethylanilineNSC9840O-NITRODIETHYLANILINE2-Nitro-N,N-diethylanilineN,n-diethyl-2-nitro-anilineN,N-Diethyl-O-nitro anilineN,N-Diethyl-2-nitroaniline #N,N-Diethyl-2-nitrobenzenamine
Show more names
SCHEMBL4365845BUBRUAQVAPTGHV-UHFFFAOYSA-DTXSID20944811BUBRUAQVAPTGHV-UHFFFAOYSA-NNSC-9840Benzenamine, N,N-diethyl-2-nitro-AKOS006242909DS-002099
Database identifiers
- CAS
2216-17-3- PubChem CID
- 222853
- DTXSID
DTXSID20944811- Nikkaji
- J150.338C
Properties
Computed structural propertiesFilling in
- XLogP
- 2.6
- Topological polar surface area
- 49.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 187
Physicochemical properties
- CAS DataBase Reference
- 2216 · 2216-17-3
- HS Code
- 2921490090 · 2921490090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2921490090
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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