1-Cyclopentyl-1H-1,2,4-triazole - CAS 1339572-17-6
Catalog: |
BB052455 |
Product Name: |
1-Cyclopentyl-1H-1,2,4-triazole |
CAS: |
1339572-17-6 |
Synonyms: |
1-cyclopentyl-1H-1,2,4-triazole |
IUPAC Name: | 1-cyclopentyl-1,2,4-triazole |
Molecular Weight: | 137.18 |
Molecular Formula: | C7H11N3 |
Canonical SMILES: | C1CCC(C1)N2C=NC=N2 |
InChI: | InChI=1S/C7H11N3/c1-2-4-7(3-1)10-6-8-5-9-10/h5-7H,1-4H2 |
InChI Key: | ZOCNEMZVMBEANK-UHFFFAOYSA-N |
Complexity: | 109 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 137.095297364 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 137.095297364 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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