AG00EDRA

63425-54-7 | 3-chloro-1-methyl-1H-pyrazole

AG00EDRA

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CAS Number	63425-54-7
Catalog Number	AG00EDRA(AGN-PC-00NGVI)
Chemical Name	3-chloro-1-methyl-1H-pyrazole
IUPAC Name	3-chloro-1-methylpyrazole
InChI	InChI=1S/C4H5ClN2/c1-7-3-2-4(5)6-7/h2-3H,1H3
InChI Key	GWZMWAZUCSGVLQ-UHFFFAOYSA-N
MDL Number	MFCD09879994
Molecular Formula	C4H5ClN2
Molecular Weight	116.5489
SMILES	CN1C=CC(Cl)=N1
Synonyms	3-Chloro-1-methyl-1H-pyrazole, 63425-54-7, 3-chloro-1-methylpyrazole, 1H-Pyrazole, 3-chloro-1-methyl-, SCHEMBL2067759, CTK1I6932, DTXSID60545442, HID1218, GWZMWAZUCSGVLQ-UHFFFAOYSA-N, CS-D1270, ANW-63126, MFCD09879994, ZINC12370914, AKOS006282568, NE40952, AJ-61917, AS-39274, QC-11212, DB-073325, TC-151871, FT-0719842, I14-103039,

Complexity	66.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	116.014g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	116.548g/mol
Monoisotopic Mass	116.014g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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