3-(1-Pyrazolyl)benzyl Alcohol - CAS 864068-80-4
Catalog: |
BB037916 |
Product Name: |
3-(1-Pyrazolyl)benzyl Alcohol |
CAS: |
864068-80-4 |
Synonyms: |
[3-(1-pyrazolyl)phenyl]methanol; (3-pyrazol-1-ylphenyl)methanol |
IUPAC Name: | (3-pyrazol-1-ylphenyl)methanol |
Description: | 3-(1-Pyrazolyl)benzyl Alcohol (CAS# 864068-80-4) is a useful research chemical. |
Molecular Weight: | 174.20 |
Molecular Formula: | C10H10N2O |
Canonical SMILES: | C1=CC(=CC(=C1)N2C=CC=N2)CO |
InChI: | InChI=1S/C10H10N2O/c13-8-9-3-1-4-10(7-9)12-6-2-5-11-12/h1-7,13H,8H2 |
InChI Key: | VINVOQJANISHSK-UHFFFAOYSA-N |
Boiling Point: | 338.9 °C at 760 mmHg |
Density: | 1.16 g/cm3 |
MDL: | MFCD06740322 |
LogP: | 1.36460 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 174.079312947 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 174.079312947 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 38 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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