2-(Trifluoromethyl)pyridine-4-methanol - CAS 131747-61-0
Catalog: |
BB007485 |
Product Name: |
2-(Trifluoromethyl)pyridine-4-methanol |
CAS: |
131747-61-0 |
Synonyms: |
[2-(trifluoromethyl)-4-pyridinyl]methanol; [2-(trifluoromethyl)pyridin-4-yl]methanol |
IUPAC Name: | [2-(trifluoromethyl)pyridin-4-yl]methanol |
Description: | 2-(Trifluoromethyl)pyridine-4-methanol (CAS# 131747-61-0 ) is a useful research chemical. |
Molecular Weight: | 177.12 |
Molecular Formula: | C7H6F3NO |
Canonical SMILES: | C1=CN=C(C=C1CO)C(F)(F)F |
InChI: | InChI=1S/C7H6F3NO/c8-7(9,10)6-3-5(4-12)1-2-11-6/h1-3,12H,4H2 |
InChI Key: | UOQWDROTEICSEX-UHFFFAOYSA-N |
Boiling Point: | 212.6 ℃ at 760 mmHg |
Density: | 1.362 g/cm3 |
Storage: | Inert atmosphere, Room Temperature |
LogP: | 1.59270 |
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 |
Publication Number | Title | Priority Date |
US-2021188868-A1 | Heterocyclic compounds as kinase inhibitors, compositions comprising the heterocyclic compound, and methods of use thereof | 20180522 |
WO-2019196918-A1 | Five-membered heterocyclo-pyrimidine compound, pharmaceutical composition and use thereof | 20180413 |
US-2020239438-A1 | Heterocyclic compounds as kinase inhibitors, compositions comprising the heterocyclic compound, and methods of use thereof | 20170822 |
US-10689354-B2 | Aminoazole derivative | 20151211 |
US-2019031628-A1 | Aminoazole derivative | 20151211 |
Complexity: | 148 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.04014830 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.04014830 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 33.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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