AG008Z4N

1089212-38-3 | 4-Bromo-3-(difluoromethyl)-1-methyl-1H-pyrazole

AG008Z4N

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CAS Number	1089212-38-3
Catalog Number	AG008Z4N(AGN-PC-073F4X)
Chemical Name	4-Bromo-3-(difluoromethyl)-1-methyl-1H-pyrazole
IUPAC Name	4-bromo-3-(difluoromethyl)-1-methylpyrazole
InChI	InChI=1S/C5H5BrF2N2/c1-10-2-3(6)4(9-10)5(7)8/h2,5H,1H3
InChI Key	VXYWCTANPTZYGM-UHFFFAOYSA-N
MDL Number	MFCD23703127
Molecular Formula	C5H5BrF2N2
Molecular Weight	211.0074
SMILES	CN1N=C(C(F)F)C(Br)=C1
Synonyms	4-Bromo-3-(difluoromethyl)-1-methyl-1H-pyrazole, 1089212-38-3, SCHEMBL1085819, DTXSID20658042, VXYWCTANPTZYGM-UHFFFAOYSA-N, MFCD23703127, ZINC91301391, AKOS016011707, FCH2329493, 4-bromo-3-difluoromethyl-N-methylpyrazole, AK123273, TZ000611, 4-bromo-3-difluoromethyl-1-methylpyrazole, AJ-129638, AX8247451, 4-bromo-3-(difluoromethyl)-1-methylpyrazole, CS-0035552, 4-bromo-3-difluoromethyl-1-methyl-1h-pyrazole,

Complexity	122
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	209.96g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	211.01g/mol
Monoisotopic Mass	209.96g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302
Packing Group	\N
Precautionary statements	P280-P305+P351+P338
UN Code	\N

Certificate of Analysis

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