AG009AI1

142808-15-9 | 4-Bromo-2-fluorobenzotrifluoride

AG009AI1

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CAS Number	142808-15-9
Catalog Number	AG009AI1(AGN-PC-0KL1YV)
Chemical Name	4-Bromo-2-fluorobenzotrifluoride
IUPAC Name	4-bromo-2-fluoro-1-(trifluoromethyl)benzene
InChI	InChI=1S/C7H3BrF4/c8-4-1-2-5(6(9)3-4)7(10,11)12/h1-3H
InChI Key	OEPBVXQEVBURGC-UHFFFAOYSA-N
MDL Number	MFCD01075254
Molecular Formula	C7H3BrF4
Molecular Weight	242.9963
SMILES	C(F)(F)(F)c1c(F)cc(cc1)Br
Synonyms	4-Bromo-2-fluorobenzotrifluoride, 142808-15-9, 4-bromo-2-fluoro-1-(trifluoromethyl)benzene, 2-fluoro-4-bromobenzotrifluoride, 1-bromo-3-fluoro-4-(trifluoromethyl)benzene, 3-Fluoro-4-(trifluoromethyl)bromobenzene, benzene, 4-bromo-2-fluoro-1-(trifluoromethyl)-, MFCD01075254, 2-fluoro-4-bromotrifluorotoluene, 4-Bromo-alpha,alpha,alpha,2-tetrafluorotoluene, 4-bromo-2-fluoro-1-trifluoromethyl-benzene, 2-FLUORO-4-BROMOTRIFLUOROMETHYLBENZENE, 4-Bromo-2-Fluoro benzotrifluoride, PubChem1641, 3-Fluoro-4-trifluoromethyl-bromobenzene, Intermediates-ZCF02088, AC1MD3B1, SCHEMBL56867, CTK5I6803, KS-00000VWH, OEPBVXQEVBURGC-UHFFFAOYSA-, DTXSID30382346, 4-bromo-2-fluoro-benzotrifluoride, OEPBVXQEVBURGC-UHFFFAOYSA-N, ACT01062, BCP14021, JRD-0571, ZINC2572589, SBB099654, 3-fluoro-4-trifluoromethylbromobenzene, AKOS005254303, AB08142, AF10070, AM61310, AN-1810, AS01041, AS01730, CM13204, CM13209, LS11607, RP28547, RTC-010867, AJ-42051, AK-49393, AS-13457, BC002193, BC253456, BR-49393, I330, SC-01069, SY020748, 1-bromo-3-fluoro-4-trifluoromethylbenzene, 4-bromo-2-fluoro-1-trifluoromethylbenzene, AB0013626, TC-010867, TL8000946, B2946, FT-0643347, FT-0659854, ST24032752, 4-Bromo-2-fluorobenzotrifluoride, AldrichCPR, MFCD01075254 (95%), B-2248, 808B159, I01-2189, I01-6197, I01-6776, J-514652, InChI=1/C7H3BrF4/c8-4-1-2-5(6(9)3-4)7(10,11)12/h1-3H, 4-bromo-2-fluoro-1-(trifluoromethyl)benzene;4-Bromo-2-fluorobenzotrifluoride, C7H3BrF4, 2-Bromo-4-fluorobenzotrifluoride, ACN-055905, CID2782904, 4-Bromo-2-fluorobenzotrifluoride - 5G 5g, 2-bromo-4-fluoro-1-(trifluoromethyl)benzene, A1513, 2-Bromo-alpha,alpha,alpha,4-tetrafluorotoluene, 4-Bromo-2-fluorobenzotrifluoride, 97% - 1G 1g, 351003-21-9,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	241.935g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	242.999g/mol
Monoisotopic Mass	241.935g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 3077

Certificate of Analysis

Lot Number