(1,3,5-Trimethyl-1H-pyrazol-4-yl)methanol - CAS 18712-39-5
Catalog: |
BB014397 |
Product Name: |
(1,3,5-Trimethyl-1H-pyrazol-4-yl)methanol |
CAS: |
18712-39-5 |
Synonyms: |
(1,3,5-trimethylpyrazol-4-yl)methanol |
IUPAC Name: | (1,3,5-trimethylpyrazol-4-yl)methanol |
Description: | (1,3,5-Trimethyl-1H-pyrazol-4-yl)methanol (CAS# 18712-39-5) is a useful research chemical. |
Molecular Weight: | 140.18 |
Molecular Formula: | C7H12N2O |
Canonical SMILES: | CC1=C(C(=NN1C)C)CO |
InChI: | InChI=1S/C7H12N2O/c1-5-7(4-10)6(2)9(3)8-5/h10H,4H2,1-3H3 |
InChI Key: | CIZQKYSGJAQKTI-UHFFFAOYSA-N |
Boiling Point: | 263.8 °C at 760 mmHg |
Density: | 1.1 g/cm3 |
MDL: | MFCD00810197 |
LogP: | 0.52920 |
GHS Hazard Statement: | H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P317, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-10851073-B2 | Protein tyrosine phosphatase inhibitors and methods of use thereof | 20190314 |
US-2020299246-A1 | Protein tyrosine phosphatase inhibitors and methods of use thereof | 20190314 |
WO-2020186199-A1 | Protein tyrosine phosphatase inhibitors and methods of use thereof | 20190314 |
TW-202100515-A | Protein tyrosine phosphatase inhibitors and methods of use thereof | 20190314 |
EA-034977-B1 | DERIVATIVES OF BENZOXASININ AND ITS ANALOGUES AS TNF ACTIVITY MODULATORS | 20150608 |
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: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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Pyrazoles
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