[3-(Trifluoromethyl)-1H-pyrazol-5-yl]methanol - CAS 169213-73-4

Catalog:	BB051865
Product Name:	[3-(Trifluoromethyl)-1H-pyrazol-5-yl]methanol
CAS:	169213-73-4
Synonyms:	1H-Pyrazole-3-methanol, 5-(trifluoromethyl)-; (5-(trifluoromethyl)-1H-pyrazol-3-yl)methanol; [3-(trifluoromethyl)pyrazol-5-yl]methan-1-ol

Technical Data

Computed Properties

IUPAC Name:	[3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
Molecular Weight:	166.10
Molecular Formula:	C5H5F3N2O
Canonical SMILES:	C1=C(NN=C1C(F)(F)F)CO
InChI:	InChI=1S/C5H5F3N2O/c6-5(7,8)4-1-3(2-11)9-10-4/h1,11H,2H2,(H,9,10)
InChI Key:	KUVPCLYQVMRTPU-UHFFFAOYSA-N
Melting Point:	121-123°C
Solubility:	Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance:	White to Off-white Solid

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Related Functional Groups

Alcohols and Derivatives

[58287-18-6]
(1R)-1-(4-Nitrophenyl)ethanol
[113724-48-4]
(R)-1-(2-Methoxyphenyl)ethanol
[64437-48-5]
(Z)-10-Hexadecenol
[62972-93-4]
(Z)-11-Octadecen-1-ol
[1448610-48-7]
1-(4-Bromo-3-methylphenyl)cyclobutanol
[18621-17-5]
1-Benzhydrylazetan-3-ol

Fluorinated Building Blocks

[1006473-17-1]
[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
[1946823-77-3]
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[1820736-42-2]
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
[479552-94-8]
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1011396-69-2]
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine

Nitrogen Compounds

[618-40-6]
1-Methyl-1-phenylhydrazine
[78056-67-4]
2-(1-Benzyl-4-piperidyl)acetonitrile
[13021-14-2]
2,4,6-Trimethyl-N-methylaniline
[514801-07-1]
3-[(4-Chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde
[158387-00-9]
3-Oxo-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propanenitrile
[5071-96-5]
3-Methoxybenzylamine

Pyrazoles

[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1855911-19-1]
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[51355-91-0]
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[62838-59-9]
1-Cyclopentyl-1H-pyrazole

Complexity:	138
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	166.03539727
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	166.03539727
Rotatable Bond Count:	1
Topological Polar Surface Area:	48.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3