1-(2,2-Difluoroethyl)-1H-1,2,4-triazol-3-amine - CAS 937602-83-0
Catalog: |
BB047501 |
Product Name: |
1-(2,2-Difluoroethyl)-1H-1,2,4-triazol-3-amine |
CAS: |
937602-83-0 |
Synonyms: |
1-(2,2-difluoroethyl)-1,2,4-triazole-3-ylamine |
IUPAC Name: | 1-(2,2-difluoroethyl)-1,2,4-triazol-3-amine |
Description: | 1-(2,2-Difluoroethyl)-1H-1,2,4-triazol-3-amine (CAS# 937602-83-0 ) is a useful research chemical. |
Molecular Weight: | 148.11 |
Molecular Formula: | C4H6F2N4 |
Canonical SMILES: | C1=NC(=NN1CC(F)F)N |
InChI: | InChI=1S/C4H6F2N4/c5-3(6)1-10-2-8-4(7)9-10/h2-3H,1H2,(H2,7,9) |
InChI Key: | JNIVULMEIXEDDD-UHFFFAOYSA-N |
Boiling Point: | 295.6±50.0 °C at 760 mmHg |
Density: | 1.62±0.1 g/cm3 |
Complexity: | 109 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 148.05605253 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 148.05605253 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 56.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.2 |
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