5-(Chloromethyl)-1-methyl-1,2,4-triazole - CAS 153851-72-0
Catalog: |
BB010943 |
Product Name: |
5-(Chloromethyl)-1-methyl-1,2,4-triazole |
CAS: |
153851-72-0 |
Synonyms: |
5-(chloromethyl)-1-methyl-1,2,4-triazole; 5-(chloromethyl)-1-methyl-1,2,4-triazole |
IUPAC Name: | 5-(chloromethyl)-1-methyl-1,2,4-triazole |
Description: | 5-(Chloromethyl)-1-methyl-1,2,4-triazole (CAS# 153851-72-0 ) is a useful research chemical. |
Molecular Weight: | 131.56 |
Molecular Formula: | C4H6ClN3 |
Canonical SMILES: | CN1C(=NC=N1)CCl |
InChI: | InChI=1S/C4H6ClN3/c1-8-4(2-5)6-3-7-8/h3H,2H2,1H3 |
InChI Key: | FRSUDGCEBGTNAB-UHFFFAOYSA-N |
LogP: | 0.55390 |
Publication Number | Title | Priority Date |
WO-2021080330-A1 | Nicotinamide compound and herbicidal composition comprising compound | 20191021 |
KR-20210047264-A | Nicotinamide Compounds and Herbicide Composition Comprising the Same | 20191021 |
US-2021106588-A1 | Bicyclic heterocycles as fgfr inhibitors | 20191014 |
WO-2021076602-A1 | Bicyclic heterocycles as fgfr inhibitors | 20191014 |
US-2015087585-A1 | Diacylglycerol acyltransferase 2 inhibitors | 20120406 |
Complexity: | 77.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 131.0250249 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 131.0250249 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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