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1-(1-Ethyl-3-methyl-1H-pyrazol-4-yl)-2,2-difluoroethanol

1-(1-Ethyl-3-methyl-1H-pyrazol-4-yl)-2,2-difluoroethanol - CAS 1174866-02-4

Catalog:	BB053102
Product Name:	1-(1-Ethyl-3-methyl-1H-pyrazol-4-yl)-2,2-difluoroethanol
CAS:	1174866-02-4
Synonyms:	1-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-2,2-difluoroethan-1-ol; 1-(1-ethyl-3-methylpyrazol-4-yl)-2,2-difluoroethan-1-ol

Technical Data

Computed Properties

IUPAC Name:	1-(1-ethyl-3-methylpyrazol-4-yl)-2,2-difluoroethanol
Molecular Weight:	190.19
Molecular Formula:	C8H12F2N2O
Canonical SMILES:	CCN1C=C(C(=N1)C)C(C(F)F)O
InChI:	InChI=1S/C8H12F2N2O/c1-3-12-4-6(5(2)11-12)7(13)8(9)10/h4,7-8,13H,3H2,1-2H3
InChI Key:	RQSXPYHWNKCNAG-UHFFFAOYSA-N
Boiling Point:	294.3±40.0 °C at 760 mmHg
Density:	1.3±0.1 g/cm3

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Related Functional Groups

Halides

[134005-20-2]
(Z)-1,3-Diiodo-2-butene
[1225940-17-9]
1-(3-Chloro-4-methylphenyl)-3-(trifluoromethyl)pyrazole-5-ylamine
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[932890-93-2]
1-{4-[(2,4-Dichlorobenzyl)oxy]-3-ethoxyphenyl}methanamine
[4860-03-1]
1-Chlorohexadecane

Oxygen Compounds

[1427004-19-0]
DBCO-PEG4-NHS ester
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[202288-73-1]
2-(Pyridin-3-ylmethoxy)aniline dihydrochloride
[56517-33-0]
2-Bromo-4-isopropoxy-5-methoxybenzaldehyde
[88-60-8]
2-tert-Butyl-5-methylphenol

Pyrazoles

[890092-87-2]
(4-Acetyl-3,5-dimethyl-1H-pyrazol-1-yl)acetic acid
[1158353-54-8]
(4-Pyrazol-1-ylphenyl)methanamine sulfuric acid
[1225940-17-9]
1-(3-Chloro-4-methylphenyl)-3-(trifluoromethyl)pyrazole-5-ylamine
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[1431965-90-0]
1-Cyclopentyl-5-methylpyrazol-3-amine hydrochloride
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole

Complexity:	168
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	190.09176933
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	190.09176933
Rotatable Bond Count:	3
Topological Polar Surface Area:	38
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9