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5-(1,3-Dimethyl-1H-pyrazol-4-yl)isoxazole-3-carbohydrazide

5-(1,3-Dimethyl-1H-pyrazol-4-yl)isoxazole-3-carbohydrazide - CAS 1004644-09-0

Catalog:	BB049719
Product Name:	5-(1,3-Dimethyl-1H-pyrazol-4-yl)isoxazole-3-carbohydrazide
CAS:	1004644-09-0
Synonyms:	5-(1,3-Dimethyl-1H-pyrazol-4-yl)isoxazole-3-carbohydrazide

Technical Data

Computed Properties

IUPAC Name:	5-(1,3-dimethylpyrazol-4-yl)-1,2-oxazole-3-carbohydrazide
Description:	5-(1,3-Dimethyl-1H-pyrazol-4-yl)isoxazole-3-carbohydrazide (CAS# 1004644-09-0 ) is a useful research chemical.
Molecular Weight:	221.22
Molecular Formula:	C9H11N5O2
Canonical SMILES:	CC1=NN(C=C1C2=CC(=NO2)C(=O)NN)C
InChI:	InChI=1S/C9H11N5O2/c1-5-6(4-14(2)12-5)8-3-7(13-16-8)9(15)11-10/h3-4H,10H2,1-2H3,(H,11,15)
InChI Key:	YJRXSTNFWXECBU-UHFFFAOYSA-N
Density:	1.5±0.1 g/cm³

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Related Functional Groups

Amines and Anilines

[1820736-42-2]
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
[1824357-78-9]
2-(1-Benzyl-3-pyrazolyl)ethylamine
[1951441-75-0]
2-(6-Methoxypyridin-2-yl)ethan-1-amine hydrochloride
[6397-33-7]
2-(Isopropylthio)aniline
[1431966-58-3]
2,2-Difluoro-N-(2-morpholin-4-ylethyl)ethanamine dihydrochloride
[1011396-69-2]
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[17746-05-3]
Undecanoyl chloride
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene

Isoxazoles

[1011398-65-4]
6-(4-(Difluoromethoxy)phenyl)-3-methylisoxazolo[5,4-b]pyridine-4-carboxylic acid
[326829-08-7]
3-Chloro-5,5-dimethyl-4,5-dihydroisoxazole
[126085-91-4]
Ethyl-5-(tributylstannyl)isoxazole-3-carboxylate
[40279-32-1]
Ethyl 2-(methylthio)-1,3-thiazole-4-carboxylate
[100189-59-1]
Ethyl 5-(2-pyridyl)-4,5-dihydroisoxazole-3-carboxylate
[7063-99-2]
Ethyl 5-phenylisoxazole-3-carboxylate

Pyrazoles

[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1158353-54-8]
(4-Pyrazol-1-ylphenyl)methanamine sulfuric acid
[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
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[1855911-19-1]
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride

Complexity:	275
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	221.09127461
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	221.09127461
Rotatable Bond Count:	2
Topological Polar Surface Area:	99
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.4