4-(Trifluoromethyl)-3-pyridinemethanol - CAS 198401-76-2
Catalog: |
BB015339 |
Product Name: |
4-(Trifluoromethyl)-3-pyridinemethanol |
CAS: |
198401-76-2 |
Synonyms: |
[4-(trifluoromethyl)-3-pyridinyl]methanol; [4-(trifluoromethyl)pyridin-3-yl]methanol |
IUPAC Name: | [4-(trifluoromethyl)pyridin-3-yl]methanol |
Description: | 4-(Trifluoromethyl)-3-pyridinemethanol (CAS# 198401-76-2) is a useful research chemical. |
Molecular Weight: | 177.12 |
Molecular Formula: | C7H6F3NO |
Canonical SMILES: | C1=CN=CC(=C1C(F)(F)F)CO |
InChI: | InChI=1S/C7H6F3NO/c8-7(9,10)6-1-2-11-3-5(6)4-12/h1-3,12H,4H2 |
InChI Key: | WQRWBLLHQHAGBM-UHFFFAOYSA-N |
Boiling Point: | 236 °C at 760 mmHg |
Density: | 1.362 g/cm3 |
LogP: | 1.59270 |
Publication Number | Title | Priority Date |
WO-2020249785-A1 | Substituted heteroaromatic pyrazolo-pyridines and their use as glun2b receptor modulators | 20190614 |
US-2021017169-A1 | Substituted heteroaromatic pyrazolo-pyridines and their use as glun2b receptor modulators | 20190614 |
US-2019330198-A1 | Compounds and uses thereof | 20180425 |
WO-2019209962-A1 | Compounds and uses thereof | 20180425 |
CN-112566636-A | Compound and use thereof | 20180425 |
Complexity: | 148 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.0401483 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.0401483 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 33.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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