AG007FB6

33468-69-8 | 4-(Trifluoromethyl)-1H-imidazole

AG007FB6

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CAS Number	33468-69-8
Catalog Number	AG007FB6(AGN-PC-0O913N)
Chemical Name	4-(Trifluoromethyl)-1H-imidazole
IUPAC Name	5-(trifluoromethyl)-1H-imidazole
InChI	InChI=1S/C4H3F3N2/c5-4(6,7)3-1-8-2-9-3/h1-2H,(H,8,9)
InChI Key	DFLGRTIPTPCKPJ-UHFFFAOYSA-N
MDL Number	MFCD08458860
Molecular Formula	C4H3F3N2
Molecular Weight	136.0752
SMILES	FC(C=1N=CNC1)(F)F
Synonyms	4-(Trifluoromethyl)-1H-imidazole, 33468-69-8, 5-(trifluoromethyl)-1H-imidazole, 4-Trifluoromethylimidazole, 4-(trifluoromethyl)imidazole, MFCD08458860, 4-Trifluoromethyl-1H-imidazole, 4(5)-(Trifluoromethyl)imidazole, DFLGRTIPTPCKPJ-UHFFFAOYSA-N, 1H-Imidazole, 4-(trifluoromethyl)-, Imidazole, 4-trifluoromethyl-, AC1LBNRE, PubChem19080, ACMC-1AILU, AC1Q4JVX, 5-trifluoromethylimidazole, 4-trifluoromethyl-imidazole, 4-Trifluoromethyl Imidazole, 4-trifluoromethyl imidazole;, KSC495Q2N, SCHEMBL392820, 5-trifluoromethyl-1H-imidazole, CHEMBL2324236, CTK3J5826, DTXSID30342920, 1H-Imidazole,5-(trifluoromethyl)-, ACT11325, EBD43308, ZINC8698428, 4-(Trifluoromethyl)-1H-imidazole #, ANW-27645, BBL101841, CT-953, CT0110, SBB085913, STL555638, AKOS007930860, AKOS026744050, AC-6896, CS-W003523, LS21245, PS-9116, QC-1427, RP20231, RTX-011967, SB13890, KS-0000027I, AJ-58070, AK-29175, BC679138, BR-29175, CJ-22678, SC-53119, SY024388, AB0024277, AJ-132658, ST2411045, 4CH-015712, AM20090510, BB 0261689, FT-0650135, W5515, 4-(Trifluoromethyl)-1H-imidazole, AldrichCPR, MFCD08458860 (98%), S-3074, 468T698, I11-0580, I14-3323, J-019202, J-513905, 1DQ, 4- -1H-imidazole, C4H3F3N2, ACN-S002131, AR-1F7307, CID585891, T2928, 4-(Trifluoromethyl)-1H-imidazole, 99% - 1G 1g, 33617-83-3,

Complexity	101
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	136.025g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	136.077g/mol
Monoisotopic Mass	136.025g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	28.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

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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