2-(1-Ethyl-1H-pyrazol-5-yl)ethan-1-ol - CAS 1339043-30-9
Catalog: |
BB052432 |
Product Name: |
2-(1-Ethyl-1H-pyrazol-5-yl)ethan-1-ol |
CAS: |
1339043-30-9 |
Synonyms: |
2-(1-ethyl-1H-pyrazol-5-yl)ethanol |
IUPAC Name: | 2-(2-ethylpyrazol-3-yl)ethanol |
Molecular Weight: | 140.18 |
Molecular Formula: | C7H12N2O |
Canonical SMILES: | CCN1C(=CC=N1)CCO |
InChI: | InChI=1S/C7H12N2O/c1-2-9-7(4-6-10)3-5-8-9/h3,5,10H,2,4,6H2,1H3 |
InChI Key: | TUKGKGIESGTCTJ-UHFFFAOYSA-N |
Complexity: | 97.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 140.094963011 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 140.094963011 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 38 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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