1-Propyl-1H-1,2,4-triazol-3-amine - CAS 58661-95-3
Catalog: |
BB030118 |
Product Name: |
1-Propyl-1H-1,2,4-triazol-3-amine |
CAS: |
58661-95-3 |
Synonyms: |
1-propyl-1,2,4-triazol-3-amine |
IUPAC Name: | 1-propyl-1,2,4-triazol-3-amine |
Description: | 1-Propyl-1H-1,2,4-triazol-3-amine (CAS# 58661-95-3) is a useful research chemical. |
Molecular Weight: | 126.16 |
Molecular Formula: | C5H10N4 |
Canonical SMILES: | CCCN1C=NC(=N1)N |
InChI: | InChI=1S/C5H10N4/c1-2-3-9-4-7-5(6)8-9/h4H,2-3H2,1H3,(H2,6,8) |
InChI Key: | RWJOWQPWDQMLRB-UHFFFAOYSA-N |
Boiling Point: | 287.3 ℃ at 760 mmHg |
Density: | 1.25 g/cm3 |
MDL: | MFCD07801138 |
LogP: | 0.85150 |
Publication Number | Title | Priority Date |
AU-2010299816-A1 | Benzoxazepin PI3K inhibitor compounds and methods of use | 20090928 |
AU-2010299816-B2 | Benzoxazepin PI3K inhibitor compounds and methods of use | 20090928 |
TW-I423980-B | Benzodiazepine PI3K inhibitor compound and method of use | 20090928 |
US-2006089316-A1 | Method for reducing a susceptibility to tumor formation induced by 3-deoxyglucosone and precursors thereof | 20041025 |
AU-4350100-A | Method for reducing a susceptibility to tumor formation induced by 3-deoxyglucosone and precursors thereof | 19990415 |
Complexity: | 85 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 126.090546336 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 126.090546336 |
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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