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1-(3-Chloro-4-methylphenyl)-3-(trifluoromethyl)pyrazole-5-ylamine

1-(3-Chloro-4-methylphenyl)-3-(trifluoromethyl)pyrazole-5-ylamine - CAS 1225940-17-9

Catalog:	BB053294
Product Name:	1-(3-Chloro-4-methylphenyl)-3-(trifluoromethyl)pyrazole-5-ylamine
CAS:	1225940-17-9
Synonyms:	1-(3-chloro-4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine

Technical Data

Computed Properties

IUPAC Name:	2-(3-chloro-4-methylphenyl)-5-(trifluoromethyl)pyrazol-3-amine
Molecular Weight:	275.66
Molecular Formula:	C11H9ClF3N3
Canonical SMILES:	CC1=C(C=C(C=C1)N2C(=CC(=N2)C(F)(F)F)N)Cl
InChI:	InChI=1S/C11H9ClF3N3/c1-6-2-3-7(4-8(6)12)18-10(16)5-9(17-18)11(13,14)15/h2-5H,16H2,1H3
InChI Key:	DVGMFBRSANDFSJ-UHFFFAOYSA-N
Boiling Point:	370.8±42.0 °C at 760 mmHg
Density:	1.5±0.1 g/cm3

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Related Functional Groups

Amines and Anilines

[556-90-1]
Pseudothiohydantoin
[1106917-71-8]
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[1250876-38-0]
1-Cyclopentyl-1H-pyrazole-3,5-diamine
[1824357-78-9]
2-(1-Benzyl-3-pyrazolyl)ethylamine
[17583-40-3]
2-(Methylamino)benzonitrile
[42150-24-3]
2-(4-Pyrazolyl)ethylamine

Halides

[1855911-19-1]
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[932890-93-2]
1-{4-[(2,4-Dichlorobenzyl)oxy]-3-ethoxyphenyl}methanamine
[444581-46-8]
1-Bromo-2-(1,1-difluoroethyl)benzene
[4860-03-1]
1-Chlorohexadecane
[199114-62-0]
2-(Chloromethyl)-3-methylquinazolin-4(3H)-one

Pyrazoles

[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1946823-77-3]
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[1082066-00-9]
1-Cyclopropyl-1H-pyrazole-4-carbaldehyde

Complexity:	300
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	275.0437095
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	275.0437095
Rotatable Bond Count:	1
Topological Polar Surface Area:	43.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.5