2,5-Dimethyl-3-nitroaniline
Basic information
- CAS
62564-50-5- Standard SMILES
Cc1cc(N)c(C)c([N+](=O)[O-])c1- InChIKey
RGSIWCOYONWAJH-UHFFFAOYSA-N- Molecular formula
- C8H10N2O2
- Average molar mass
- 166.18 g/mol
- Monoisotopic mass
- 166.07422756
Names & identifiers
- Preferred name
- 2,5-Dimethyl-3-nitroaniline
- IUPAC
- 2,5-dimethyl-3-nitroaniline
- English name
- 2-Amino-6-nitro-1,4-dimethylbenzene
- Molecular formula
- C8H10N2O2
- Molecular weight
- 166.18
Names & synonyms
2,5-dimethyl-3-nitroaniline62564-50-5Benzenamine, 2,5-dimethyl-3-nitro-NSC149771SCHEMBL2598132,5-dimethyl-3-nitro-anilineDTXSID70302225RGSIWCOYONWAJH-UHFFFAOYSA-NAKOS006285225NSC 149771NSC-149771CS-0358994
Show more names
3-Nitro-2,5-xylidine2,5-Dimethyl-3-nitrobenzenamine2-Amino-6-nitro-1,4-dimethylbenzene2-AMINO-1,4-DIMETHYL-6-NITROBENZENE
AE-562/43459618
Database identifiers
- CAS
62564-50-5- PubChem CID
- 288528
- DTXSID
DTXSID70302225- Nikkaji
- J141.320A
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 71.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 178
Physicochemical properties
- storage temp.
- 2 · 2-8°C
Related reactions
6 records
Compound notes
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