(1-Ethyl-3-methyl-1H-pyrazol-4-yl)methanol - CAS 494214-30-1
Catalog: |
BB044755 |
Product Name: |
(1-Ethyl-3-methyl-1H-pyrazol-4-yl)methanol |
CAS: |
494214-30-1 |
Synonyms: |
(1-ethyl-3-methylpyrazol-4-yl)methan-1-ol; 1H-pyrazole-4-methanol, 1-ethyl-3-methyl- |
IUPAC Name: | (1-ethyl-3-methylpyrazol-4-yl)methanol |
Description: | (1-Ethyl-3-methyl-1H-pyrazol-4-yl)methanol (CAS# 494214-30-1 ) is a useful research chemical. |
Molecular Weight: | 140.18 |
Molecular Formula: | C7H12N2O |
Canonical SMILES: | CCN1C=C(C(=N1)C)CO |
InChI: | InChI=1S/C7H12N2O/c1-3-9-4-7(5-10)6(2)8-9/h4,10H,3,5H2,1-2H3 |
InChI Key: | DEJRCKAOAKAAHB-UHFFFAOYSA-N |
Boiling Point: | 264.3±25.0 °C (Predicted) |
Purity: | ≥ 95 % |
Density: | 1.09±0.1 g/cm3 (Predicted) |
Complexity: | 108 |
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: | 2 |
Topological Polar Surface Area: | 38 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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