AG003GPO

40161-55-5 | 1-Bromo-4-fluoro-2-(trifluoromethyl)benzene

AG003GPO

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CAS Number	40161-55-5
Catalog Number	AG003GPO(AGN-PC-0JS9S3)
Chemical Name	1-Bromo-4-fluoro-2-(trifluoromethyl)benzene
IUPAC Name	1-bromo-4-fluoro-2-(trifluoromethyl)benzene
InChI	InChI=1S/C7H3BrF4/c8-6-2-1-4(9)3-5(6)7(10,11)12/h1-3H
InChI Key	AIDVAZGOACECLJ-UHFFFAOYSA-N
MDL Number	MFCD00040937
Molecular Formula	C7H3BrF4
Molecular Weight	242.9963
SMILES	FC(C1=CC(F)=CC=C1Br)(F)F
Synonyms	2-Bromo-5-fluorobenzotrifluoride, 40161-55-5, 1-Bromo-4-fluoro-2-(trifluoromethyl)benzene, 1-bromo-2-(trifluoromethyl)-4-fluorobenzene, MFCD00040937, 4-fluoro-2-(trifluoromethyl)bromobenzene, 2-Bromo-alpha,alpha,alpha,5-tetrafluorotoluene, BENZENE, 1-BROMO-4-FLUORO-2-(TRIFLUOROMETHYL)-, 2-bromo-5-fluoro benzotrifluoride, AIDVAZGOACECLJ-UHFFFAOYSA-N, 40161-55-5 2-bromo-5-fluorobenzotrifluoride, PubChem1637, PubChem1643, AC1LAUYQ, ACMC-209jbf, SCHEMBL624437, CTK7B8630, DTXSID20334516, 2-bromo-5-fluoro-benzotrifluoride, 2-bromo-5-fluorobenzo trifluoride, WT189, ACT09674, BCP24572, KS-00000D8H, ANW-29305, SBB099651, WT2179, ZINC49952245, AKOS005254951, AC-6881, AN-9550, AS01040, CM13205, CS-W012759, LF10070, PS-7547, RTR-016030, VF10005, AK-35039, BC002194, BC226450, BP-10501, BR-35039, SC-45996, SY013796, 1-bromo-4-fluoro-2-trifluoromethylbenzene, bromo-4-fluoro-2-(trifluoromethyl)benzene, AB0011777, AJ-111522, TL8002905, AM20060282, B2800, FT-0611484, ST24032209, ST50408644, J3.542.511J, 1-Bromo-4-fluoro-2-(trifluoromethyl)benzene #, C-4667, MFCD00040937 (97+%), C7H3BrF4, 5-Bromo-2-fluorobenzotrifluoride, 2-fluoro-5-bromo benzotrifluoride, CID520983, MFCD00042493, ACN-053244, 2-Bromo-5-fluorobenzotrifluoride, 97%, 2-Bromo-5-fluorobenzotrifluoride, 97% - 100G 100g, 393-37-3,

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
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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