AG003MG4

886762-08-9 | 3-Amino-4-(trifluoromethoxy)bromobenzene

AG003MG4

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CAS Number	886762-08-9
Catalog Number	AG003MG4(AGN-PC-0KKZIN)
Chemical Name	3-Amino-4-(trifluoromethoxy)bromobenzene
IUPAC Name	5-bromo-2-(trifluoromethoxy)aniline
InChI	InChI=1S/C7H5BrF3NO/c8-4-1-2-6(5(12)3-4)13-7(9,10)11/h1-3H,12H2
InChI Key	FOJWHUFRHXEUBA-UHFFFAOYSA-N
MDL Number	MFCD04039242
Molecular Formula	C7H5BrF3NO
Molecular Weight	256.0199
SMILES	NC1=CC(Br)=CC=C1OC(F)(F)F
Synonyms	5-bromo-2-(trifluoromethoxy)aniline, 886762-08-9, 3-Amino-4-(trifluoromethoxy)BromoBenzene, 5-bromo-2-trifluoromethoxyaniline, 5-Bromo-2-trifluoromethoxy-phenylamine, 3-Amino-4-(trifluoromethoxy)bromobenzene98%, 2-AMINO-4-BROMO(TRIFLUOROMETHOXY)BENZENE, AC1MCVDU, PubChem18522, ACMC-209qwe, KSC495M1J, SCHEMBL526369, CTK3J5614, DTXSID90381416, FOJWHUFRHXEUBA-UHFFFAOYSA-N, 5-bromo-2-trifluoromethoxy aniline, ZINC2525757, ANW-39132, MFCD04039242, SBB101654, TD1079, 2-trifluoromethoxy-5-bromo-phenylamine, AKOS015834783, AM61689, AN-1551, AS06957, CB-2744, CS-W003143, PS-7409, RTC-060398, TF10584, TRA0021366, 3-Amino-4-(trifluoromethoxy)bromobenzen, 5-bromo-2-(trifluoromethoxy)benzenamine, 5-bromo-2-(trifluoromethoxy)phenylamine, KS-000009X5, 5-bromanyl-2-(trifluoromethyloxy)aniline, AC-28691, AJ-37517, AK-36753, BC004377, BR-36753, CJ-08855, SC-23928, SY020762, AB0030678, DB-024278, TC-060398, Benzenamine, 5-bromo-2-(trifluoromethoxy)-, FT-0081830, FT-0612081, ST24029355, TL80074103, X2891, A10649, B-5016, MFCD04039242 (97+%), A842833, I01-3928, C7H5BrF3NO, 3-Amino-4- BromoBenzene, ACN-050355, CID2779367, 5-Bromo-2-(trifluoromethoxy)aniline - 5G 5g,

Complexity	176
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	254.951g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	256.022g/mol
Monoisotopic Mass	254.951g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H312-H332-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338-P304+P340-P405-P501
UN Code	UN 2810

Certificate of Analysis

Lot Number