4-(3,5-Dimethylpyrazol-1-yl)benzyl Alcohol - CAS 934570-55-5
Catalog: |
BB040930 |
Product Name: |
4-(3,5-Dimethylpyrazol-1-yl)benzyl Alcohol |
CAS: |
934570-55-5 |
Synonyms: |
[4-(3,5-dimethyl-1-pyrazolyl)phenyl]methanol; [4-(3,5-dimethylpyrazol-1-yl)phenyl]methanol |
IUPAC Name: | [4-(3,5-dimethylpyrazol-1-yl)phenyl]methanol |
Description: | 4-(3,5-Dimethylpyrazol-1-yl)benzyl Alcohol (CAS# 934570-55-5) is a useful research chemical. |
Molecular Weight: | 202.25 |
Molecular Formula: | C12H14N2O |
Canonical SMILES: | CC1=CC(=NN1C2=CC=C(C=C2)CO)C |
InChI: | InChI=1S/C12H14N2O/c1-9-7-10(2)14(13-9)12-5-3-11(8-15)4-6-12/h3-7,15H,8H2,1-2H3 |
InChI Key: | HROWBOXYWTWPCS-UHFFFAOYSA-N |
Boiling Point: | 350.8 ℃ at 760 mmHg |
Density: | 1.12 g/cm3 |
MDL: | MFCD07324815 |
LogP: | 1.98140 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 202 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.110613074 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.110613074 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 38 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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