(1,3-Dimethyl-1H-pyrazole-5-yl)methanol - CAS 57012-20-1
Catalog: |
BB050063 |
Product Name: |
(1,3-Dimethyl-1H-pyrazole-5-yl)methanol |
CAS: |
57012-20-1 |
Synonyms: |
1H-Pyrazole-5-methanol, 1,3-dimethyl-; (1,3-Dimethyl-1H-pyrazole-5-yl)methanol |
IUPAC Name: | (2,5-dimethylpyrazol-3-yl)methanol |
Description: | (1,3-Dimethyl-1H-pyrazole-5-yl)methanol (CAS# 57012-20-1 ) is a useful research chemical. |
Molecular Weight: | 126.16 |
Molecular Formula: | C6H10N2O |
Canonical SMILES: | CC1=NN(C(=C1)CO)C |
InChI: | InChI=1S/C6H10N2O/c1-5-3-6(4-9)8(2)7-5/h3,9H,4H2,1-2H3 |
InChI Key: | GUJDKMVLHCJODO-UHFFFAOYSA-N |
Boiling Point: | 248.6±25.0 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.1±0.1 g/cm3 |
Appearance: | Light yellow solid |
MDL: | MFCD02682037 |
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: | -0.2 |
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