Basic information
- CAS
14876-25-6- Standard SMILES
CCN(CCO)c1ccc(N)c(C)c1.O=[N+]([O-])O- InChIKey
XJHFXNXVOUMVLF-UHFFFAOYSA-N- Molecular formula
- C11H19N3O4
- Average molar mass
- 257.29 g/mol
- Monoisotopic mass
- 257.1375561
Names & identifiers
- Preferred name
- 2-(4-Amino-N-ethyl-m-toluidino)ethanol nitrate
- IUPAC
- 2-(4-amino-N-ethyl-3-methylanilino)ethanol;nitric acid
- English name
- 2-(4-amino-N-ethyl-m-toluidino)ethanol nitrate
- Molecular formula
- C11H17N3O3
- Molecular weight
- 239.27098
Names & synonyms
2-(4-Amino-N-ethyl-m-toluidino)ethanol nitrateEINECS 238-950-5SCHEMBL98445512-(4-amino-N-ethyl-3-methylanilino)ethanol;nitric acidDTXSID60164096XJHFXNXVOUMVLF-UHFFFAOYSA-N69AC58L65ANS00085611Ethanol, 2-[(4-amino-3-methylphenyl)ethylamino]-, nitrate (1:?)Nitric acid--2-[(4-amino-3-methylphenyl)(ethyl)amino]ethan-1-ol (1/1)2-(4-amino-N-ethyl-3-methylanilino)ethanol,nitric acid
Database identifiers
- CAS
14876-25-6- PubChem CID
- 84679
- DTXSID
DTXSID60164096- UNII
- 69AC58L65A
- EC Number
- 238-950-5
Properties
Computed structural properties
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 188
Physicochemical properties
- FDA UNII
- 69 AC58L65A · 69AC58L65A
Chemistry & industry
Suppliers2 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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