Basic information
- CAS
71130-60-4- Standard SMILES
CCNCc1cc([N+](=O)[O-])ccc1O- InChIKey
BXQBOFZTTUXRNK-UHFFFAOYSA-N- Molecular formula
- C9H12N2O3
- Average molar mass
- 196.2 g/mol
- Monoisotopic mass
- 196.08479225
Names & identifiers
- Preferred name
- 2-((Ethylamino)methyl)-4-nitrophenol
- IUPAC
- 2-(ethylaminomethyl)-4-nitrophenol
- English name
- 2-[(Ethylamino)methyl]-4-nitrophenol
- Molecular formula
- C9H12N2O3
- Molecular weight
- 196.2
Names & synonyms
2-[(ethylamino)methyl]-4-nitrophenolPhenol, 2-[(ethylamino)methyl]-4-nitro-2-((Ethylamino)methyl)-4-nitrophenolPhenol, 2-((ethylamino)methyl)-4-nitro-N-Ethyl-2-hydroxy-5-nitrobenzenemethanamineDTXSID2072257RefChem:249506DTXCID2046913BXQBOFZTTUXRNK-UHFFFAOYSA-N71130-60-42-(ethylaminomethyl)-4-nitrophenol2-[(ethylazaniumyl)methyl]-4-nitrophenolate
Show more names
2-((N-Ethylamino)methyl)-4-nitrophenolN-ETHYL-2-HYDROXY-5-NITROBENZENEMETHANAMIDE
Phenol,2-[(ethylamino)methyl]-4-nitro-SCHEMBL6412685AKOS009077652FE23132DB-313272
Database identifiers
- CAS
71130-60-4- PubChem CID
- 94665
- DTXSID
DTXSID2072257- Nikkaji
- J446.690J
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- Melting point
- 200 · 200-2010C
- solubility
- DMSO (Slightly), Water (Slightly, Heated)
- form
- Solid
- color
- Yellow
- EPA Substance Registry System
- 2 · Phenol, 2-[(ethylamino)methyl]-4-nitro- (71130-60-4)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhenol, 2-[(ethylamino)methyl]-4-nitro-: INACTIVE
Applications
Uses2-[(Ethylamino)methyl]-4-nitrophenol is used in synthesis of some novel amodiaquine analogs as potential antimalarial and antifilarial compounds.
Upstream & downstream products
Downstream products
Suppliers6 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
合肥凯米克生化科技有限公司19710560120 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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