AG003HA1

393-37-3 | 5-Bromo-2-fluorobenzotrifluoride

AG003HA1

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CAS Number	393-37-3
Catalog Number	AG003HA1(AGN-PC-0KK7QQ)
Chemical Name	5-Bromo-2-fluorobenzotrifluoride
IUPAC Name	4-bromo-1-fluoro-2-(trifluoromethyl)benzene
InChI	InChI=1S/C7H3BrF4/c8-4-1-2-6(9)5(3-4)7(10,11)12/h1-3H
InChI Key	AJLIJYGWAXPEOK-UHFFFAOYSA-N
MDL Number	MFCD00042493
Molecular Formula	C7H3BrF4
Molecular Weight	242.9963
SMILES	FC(F)(F)C1=CC(Br)=CC=C1F
Synonyms	5-Bromo-2-fluorobenzotrifluoride, 393-37-3, 4-bromo-1-fluoro-2-(trifluoromethyl)benzene, 2-fluoro-5-bromobenzotrifluoride, 4-Fluoro-3-(trifluoromethyl)bromobenzene, 2-fluoro-5-bromo benzotrifluoride, 5-Bromo-alpha,alpha,alpha,2-tetrafluorotoluene, 1-BROMO-4-FLUORO-3-(TRIFLUOROMETHYL)BENZENE, 5-bromo-2-fluoro-(trifluoromethyl)benzene, AJLIJYGWAXPEOK-UHFFFAOYSA-N, MFCD00042493, 5-Bromo-2-fluorobenzotrifluoride, 97%, Benzene, 4-bromo-1-fluoro-2-(trifluoromethyl)-, ACMC-209j4s, AC1MC5C0, SCHEMBL690073, AJLIJYGWAXPEOK-UHFFFAOYSA-, CTK5I6677, DTXSID10371278, 5-bromo-2-fluoro-benzotrifluoride, ACT13094, JRD-0414, ZINC2584342, ANW-29066, SBB099649, AKOS005258449, AB01925, AC-4117, AS01039, AS01735, CS-W014137, LF10066, MCULE-3396838504, PS-7548, RP28546, RTR-032829, AJ-43412, AK-25901, AN-12312, BC002199, BR-25901, SC-04134, SY005472, 4-bromo-1-fluoro-2-trifluoromethyl-benzene, AB0011759, ST2411790, TL8002840, AM20060390, B2872, FT-0615183, ST50408581, 4-bromo-1-fluoro-2-(trifluoromethyl)-benzene, EN300-92091, C-4683, MFCD00042493 (97+%), 1-BROMO-3-(TRIFLUOROMETHYL)-4-FLUOROBENZENE, I01-2549, J-516928, InChI=1/C7H3BrF4/c8-4-1-2-6(9)5(3-4)7(10,11)12/h1-3H, C7H3BrF4, 2-Bromo-4-fluorobenzotrifluoride, 2-Bromo-5-fluorobenzotrifluoride, 2-Bromo-6-fluorobenzotrifluoride, ACN-055912, CID2736325, 2-Bromo-5-fluorobenzotrifluoride, 97%, 3-Fluoro-2-(trifluoromethyl)bromobenzene, 4-fluoro-2-(trifluoromethyl)bromobenzene, 1-bromo-2-(trifluoromethyl)-4-fluorobenzene, 1-bromo-3-fluoro-2-(trifluoromethyl)benzene, 1-Bromo-4-fluoro-2-(trifluoromethyl)benzene, 2-bromo-4-fluoro-1-(trifluoromethyl)benzene, 2-Bromo-alpha,alpha,alpha,4-tetrafluorotoluene, 2-Bromo-alpha,alpha,alpha,5-tetrafluorotoluene, 5-Bromo-2-fluorobenzotrifluoride, 98% - 25G 25g, 40161-55-5,

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

Lot Number