Basic information
- CAS
63764-05-6- Standard SMILES
CN(C)CCNc1ccc([N+](=O)[O-])cn1- InChIKey
ITTCITPABROWSB-UHFFFAOYSA-N- Molecular formula
- C9H14N4O2
- Average molar mass
- 210.23 g/mol
- Monoisotopic mass
- 210.11167569
Names & identifiers
- Preferred name
- N,N-dimethyl-N'-(5-nitropyridin-2-yl)ethane-1,2-diamine
- IUPAC
- N',N'-dimethyl-N-(5-nitro-2-pyridinyl)ethane-1,2-diamine
- English name
- N1,N1-dimethyl-N2-(5-nitro-2-pyridinyl)-1,2-Ethanediamine
- Molecular formula
- C9H14N4O2
- Molecular weight
- 210.23
Names & synonyms
63764-05-6N,N-dimethyl-N'-(5-nitropyridin-2-yl)ethane-1,2-diamine1,2-Ethanediamine, N,N-dimethyl-N'-(5-nitro-2-pyridinyl)-AI-204/33262025N',N'-dimethyl-N-(5-nitropyridin-2-yl)ethane-1,2-diamineSCHEMBL2681134SCHEMBL30648848DTXSID00395185ITTCITPABROWSB-UHFFFAOYSA-NAKOS008994853DA-418332-{[2-(dimethylamino)ethyl]amino}-5-nitropyridine
Show more names
N1,N1-dimethyl-N2-(5-nitro-2-pyridinyl)-1,2-Ethanediamine1,2-Ethanediamine, N1,N1-dimethyl-N2-(5-nitro-2-pyridinyl)-
N1,N1-dimethyl-N2-(5-nitropyridin-2-yl)ethane-1,2-diamineN~1~,N~1~-Dimethyl-N~2~-(5-nitropyridin-2-yl)ethane-1,2-diamine
Database identifiers
- CAS
63764-05-6- PubChem CID
- 3696952
- DTXSID
DTXSID00395185
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 74 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 205
Physicochemical properties
- Boiling point
- 358 · 358.0±37.0 °C(Predicted)
- Density
- 1.231 · 1.231±0.06 g/cm3(Predicted)
- pka
- 8.93 · 8.93±0.28(Predicted)
Chemistry & industry
Suppliers2 total
德拜科技有限公司00852-2521 1836
SPECS[email protected]
Related reactions
4 records
Compound notes
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