AG003EEP

438630-64-9 | 1H-Pyrazole-4-sulfonyl chloride

AG003EEP

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CAS Number	438630-64-9
Catalog Number	AG003EEP(AGN-PC-03U09P)
Chemical Name	1H-Pyrazole-4-sulfonyl chloride
IUPAC Name	1H-pyrazole-4-sulfonyl chloride
InChI	InChI=1S/C3H3ClN2O2S/c4-9(7,8)3-1-5-6-2-3/h1-2H,(H,5,6)
InChI Key	MRPFJQLRQGTKNI-UHFFFAOYSA-N
MDL Number	MFCD09701481
Molecular Formula	C3H3ClN2O2S
Molecular Weight	166.5861
SMILES	ClS(=O)(=O)C1=CNN=C1
Synonyms	1H-pyrazole-4-sulfonyl chloride, 438630-64-9, 4-Chlorosulfonylpyrazole, 1H-Pyrazole-4-sulfonylchloride, AC1Q3VNA, chloropyrazol-4-ylsulfone, pyrazole-4-sulfonyl chloride, SCHEMBL624092, CTK1D5367, 1H-pyrazole-4-sulphonyl chloride, DTXSID30627921, MRPFJQLRQGTKNI-UHFFFAOYSA-N, KS-00000HW0, 6053AB, ANW-55080, BBL031377, MFCD09701481, SBB024686, STK351646, ZINC97972254, AKOS000505593, MCULE-5028589725, RTR-017000, TRA-0199596, AK-75850, AM803911, BS-13068, AB0154012, TR-017000, 1H-Pyrazole-4-sulfonyl chloride, AldrichCPR, FT-0678212, ST24038294, ST50572930, EN300-49990, F2158-1817, C3H3ClN2O2S, T0761, 288148-34-5,

Complexity	185
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	165.96g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	166.579g/mol
Monoisotopic Mass	165.96g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	71.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

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