1-(1,5-Dimethyl-1H-pyrazol-4-yl)ethanol - CAS 108905-82-4
Catalog: |
BB053093 |
Product Name: |
1-(1,5-Dimethyl-1H-pyrazol-4-yl)ethanol |
CAS: |
108905-82-4 |
Synonyms: |
1-(1,5-Dimethyl-1H-pyrazol-4-yl)-ethanol; 1-(1,5-dimethyl-1H-pyrazol-4-yl)ethan-1-ol; 1-(1,5-dimethylpyrazol-4-yl)ethan-1-ol |
IUPAC Name: | 1-(1,5-dimethylpyrazol-4-yl)ethanol |
Molecular Weight: | 140.18 |
Molecular Formula: | C7H12N2O |
Canonical SMILES: | CC1=C(C=NN1C)C(C)O |
InChI: | InChI=1S/C7H12N2O/c1-5-7(6(2)10)4-8-9(5)3/h4,6,10H,1-3H3 |
InChI Key: | XTDMIVDJHBYFPN-UHFFFAOYSA-N |
Boiling Point: | 250.1±25.0 °C at 760 mmHg |
Purity: | 95% |
Density: | 1.1±0.1 g/cm3 |
Complexity: | 118 |
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: | 1 |
Topological Polar Surface Area: | 38 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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