AG0036W8

660845-30-7 | 5-Chloro-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbaldehyde

AG0036W8

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CAS Number	660845-30-7
Catalog Number	AG0036W8(AGN-PC-02JM8V)
Chemical Name	5-Chloro-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbaldehyde
IUPAC Name	5-chloro-3-(difluoromethyl)-1-methylpyrazole-4-carbaldehyde
InChI	InChI=1S/C6H5ClF2N2O/c1-11-5(7)3(2-12)4(10-11)6(8)9/h2,6H,1H3
InChI Key	NMYPMEAFQUDCSC-UHFFFAOYSA-N
MDL Number	MFCD00168044
Molecular Formula	C6H5ClF2N2O
Molecular Weight	194.5665
SMILES	ClC1=C(C(=NN1C)C(F)F)C=O
Synonyms	5-CHLORO-3-(DIFLUOROMETHYL)-1-METHYL-1H-PYRAZOLE-4-CARBALDEHYDE, 660845-30-7, 1H-Pyrazole-4-carboxaldehyde, 5-chloro-3-(difluoromethyl)-1-methyl-, PubChem16989, SCHEMBL440614, CTK5C3482, KS-00000OBN, DTXSID20599562, NMYPMEAFQUDCSC-UHFFFAOYSA-N, MFCD12827692, ZINC44831820, AKOS012178212, SB18299, AC-27617, AK-67613, DS-16687, AJ-110191, DB-073706, RT-010271, CS-0044325, FT-0725525, ST24044628, C-2406, 5-chloro-1-methyl-3-difluoromethyl-1H-pyrazole-4-carbaldehyde, 5-chloro-3-difluoromethyl-1-methyl-1H-pyrazole-4-carboaldehyde, 5-CHLORO-3-(DIFLUOROMETHYL)-1-METHYLPYRAZOLE-4-CARBALDEHYDE,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.006g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	194.566g/mol
Monoisotopic Mass	194.006g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	34.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number