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1-Cyclopentyl-3-methyl-1h-pyrazole-5-sulfonyl chloride

1-Cyclopentyl-3-methyl-1h-pyrazole-5-sulfonyl chloride - CAS 1245806-72-7

Catalog:	BB053335
Product Name:	1-Cyclopentyl-3-methyl-1h-pyrazole-5-sulfonyl chloride
CAS:	1245806-72-7
Synonyms:	1-cyclopentyl-3-methyl-1h-pyrazole-5-sulfonylchloride

Technical Data

Computed Properties

IUPAC Name:	2-cyclopentyl-5-methylpyrazole-3-sulfonyl chloride
Molecular Weight:	248.73
Molecular Formula:	C9H13ClN2O2S
Canonical SMILES:	CC1=NN(C(=C1)S(=O)(=O)Cl)C2CCCC2
InChI:	InChI=1S/C9H13ClN2O2S/c1-7-6-9(15(10,13)14)12(11-7)8-4-2-3-5-8/h6,8H,2-5H2,1H3
InChI Key:	JJPKWCSOOOBIPT-UHFFFAOYSA-N
Boiling Point:	385.8±30.0 °C at 760 mmHg
Density:	1.5±0.1 g/cm3

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Related Functional Groups

Cyclopentane

[1431965-90-0]
1-Cyclopentyl-5-methylpyrazol-3-amine hydrochloride
[1018163-64-8]
2-Cyclopentyl-3,4-dimethyl-2H-pyrazolo[3,4-b]pyridin-6(7H)-one
[158414-44-9]
(1R,2R)-2-aminocyclopentane-1-carboxylic acid hydrochloride
[911060-82-7]
1-(Hydroxymethyl)cyclopentane-1-carbonitrile
[169868-13-7]
(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid
[351342-00-2]
WAY-301207

Halides

[1106917-71-8]
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[1855911-19-1]
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
[51355-91-0]
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[199114-62-0]
2-(Chloromethyl)-3-methylquinazolin-4(3H)-one
[1431966-58-3]
2,2-Difluoro-N-(2-morpholin-4-ylethyl)ethanamine dihydrochloride

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
[1855911-19-1]
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
[1820736-42-2]
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
[957292-12-5]
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid

Sulfur Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[71996-48-0]
1-Methyl-2-[(phenylsulfonyl)methyl]benzene
[42729-26-0]
3-(Trifluoromethylthio)phenyl isothiocyanate
[15863-41-9]
4-(Methylthio)phenyl isothiocyanate
[5310-68-9]
4-Chlorophenylsulphur pentafluoride
[2170450-99-2]
4-Methyl-1-(phenylsulfonyl)-1H-indole-2-carbonitrile

Complexity:	322
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	248.0386265
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	248.0386265
Rotatable Bond Count:	2
Topological Polar Surface Area:	60.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2