(1,4-Dimethyl-1H-pyrazol-5-yl)methanol - CAS 1607024-78-1
Catalog: |
BB050789 |
Product Name: |
(1,4-Dimethyl-1H-pyrazol-5-yl)methanol |
CAS: |
1607024-78-1 |
Synonyms: |
(2,4-Dimethyl-2H-pyrazol-3-yl)-methanol; 1H-Pyrazole-5-methanol, 1,4-dimethyl- |
IUPAC Name: | (2,4-dimethylpyrazol-3-yl)methanol |
Molecular Weight: | 126.16 |
Molecular Formula: | C6H10N2O |
Canonical SMILES: | CC1=C(N(N=C1)C)CO |
InChI: | InChI=1S/C6H10N2O/c1-5-3-7-8(2)6(5)4-9/h3,9H,4H2,1-2H3 |
InChI Key: | MFLUBISSILXSRS-UHFFFAOYSA-N |
Boiling Point: | 258.6±25.0°C at 760 mmHg |
Purity: | ≥95% |
Density: | 1.1±0.1 g/cm3 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 97.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 126.079312947 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 126.079312947 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 38 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.3 |
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