AG004M5H

852227-86-2 | 5-(ChloroMethyl)-1,3-diMethyl-1H-pyrazole

AG004M5H

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CAS Number	852227-86-2
Catalog Number	AG004M5H(AGN-PC-0LK8F3)
Chemical Name	5-(ChloroMethyl)-1,3-diMethyl-1H-pyrazole
IUPAC Name	5-(chloromethyl)-1,3-dimethylpyrazole
InChI	InChI=1S/C6H9ClN2/c1-5-3-6(4-7)9(2)8-5/h3H,4H2,1-2H3
InChI Key	SGEZKPNUNBVVLB-UHFFFAOYSA-N
MDL Number	MFCD07368502
Molecular Formula	C6H9ClN2
Molecular Weight	144.6021
SMILES	CC1=NN(C)C(CCl)=C1
Synonyms	5-(chloromethyl)-1,3-dimethyl-1H-pyrazole, 852227-86-2, 5-(chloromethyl)-1,3-dimethylpyrazole, 1H-Pyrazole, 5-(chloromethyl)-1,3-dimethyl-, 5-Chloromethyl-1,3-dimethyl-1H-pyrazole, MFCD07368502, 5-(Chloromethyl)-1,3-dimethyl-1H-pyrazole, 97%, 5-(chloromethyl)-1, AC1NLOYU, PubChem23625, 3-dimethyl-1h-pyrazole, SCHEMBL343813, CTK5F4566, DTXSID60406903, SGEZKPNUNBVVLB-UHFFFAOYSA-N, 5-(chloromethyl)-1,3-dime..., ACN-P000915, BCP23450, ZINC4277269, ANW-48809, BBL104339, SBB025118, STK352061, AKOS005168010, MCULE-6761013248, PB10408, QC-4074, RP01437, RTC-068519, KS-000006R3, 5-chloromethyl-1,4-dimethyl-1h-pyrazole, AJ-50074, AK-48543, AS-34365, BR-48543, SC-43829, SY041961, AB0002355, ST2418574, TC-068519, CS-0006092, FT-0685106, W8800, 1H-Pyrazole,5-(chloromethyl)-1,3-dimethyl-, MFCD07368502 (97%), H09021, 5-chloromethyl-1,3-dimethyl-1h-pyrazole ,97%, I11-0550, J-516309, 5 - Chloromethyl - 1,3 - dimethyl - 1H - pyrazole, 5-(chloromethyl)-1,3-dimethyl-1H-pyrazole, AldrichCPR, C6H9ClN2, ZINC04277269, CID4961270, 5- -1,3-DIMETHYL-1H-PYRAZOLE, A10223, C-1770, 5-(chloromethyl)-1,3-dimethyl-4,5-dihydro-1h-pyrazole, 5-Chloromethyl-1,3-dimethyl-1H-pyrazole, 97% - 1G 1g,

Complexity	97.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	144.045g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	144.602g/mol
Monoisotopic Mass	144.045g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

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