N'-ethyl-1H-1,2,3-benzotriazole-1-carboximidamide
Completing data — refresh the page later to see the latest
Basic information
- CAS
1314924-36-1- Standard SMILES
CCNC(=N)n1nnc2ccccc21- InChIKey
WCKNBJBYMZYWPX-UHFFFAOYSA-N- Molecular formula
- C9H11N5
- Average molar mass
- 189.22 g/mol
- Monoisotopic mass
- 189.10144537
Names & identifiers
- Preferred name
- N'-ethyl-1H-1,2,3-benzotriazole-1-carboximidamide
- IUPAC
- N'-ethylbenzotriazole-1-carboximidamide
- English name
- N-ethyl-1H-benzo[d][1,2,3]triazol-1-carboxiMidaMide
- Molecular formula
- C9H11N5
- Molecular weight
- 189.22
Names & synonyms
N'-ethyl-1H-1,2,3-benzotriazole-1-carboximidamide1314924-36-1AKOS006320006N-Ethyl-1H-benzotriazole-1-carboximidamide1H-Benzotriazole-1-carboximidamide, N-ethyl-N-ethyl-1H-benzo[d][1,2,3]triazol-1-carboxiMidaMide
Database identifiers
- CAS
1314924-36-1- PubChem CID
- 55271006
Properties
Computed structural propertiesFilling in
- XLogP
- 0.9
- Topological polar surface area
- 69.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 227
Physicochemical properties
- Boiling point
- 309.2 · 309.2±25.0 °C(Predicted)
- Density
- 1.33 · 1.33±0.1 g/cm3(Predicted)
- pka
- 5.72 · 5.72±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…