AG007FZ8

1049730-91-7 | 2-BROMO-4-METHOXY-1-(TRIFLUOROMETHOXY)BENZENE

AG007FZ8

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CAS Number	1049730-91-7
Catalog Number	AG007FZ8(AGN-PC-0WAMVP)
Chemical Name	2-BROMO-4-METHOXY-1-(TRIFLUOROMETHOXY)BENZENE
IUPAC Name	2-bromo-4-methoxy-1-(trifluoromethoxy)benzene
InChI	InChI=1S/C8H6BrF3O2/c1-13-5-2-3-7(6(9)4-5)14-8(10,11)12/h2-4H,1H3
InChI Key	MWWJZKUPSAEIOT-UHFFFAOYSA-N
MDL Number	MFCD20485915
Molecular Formula	C8H6BrF3O2
Molecular Weight	271.0312
SMILES	FC(F)(F)OC1=CC=C(OC)C=C1Br
Synonyms	2-Bromo-4-methoxy-1-(trifluoromethoxy)benzene, 1049730-91-7, 3-bromo-4-trifluoromethoxyanisole, 2-Bromo-4-methoxy-1-trifluoromethoxy-benzene, SCHEMBL263498, CTK8B6158, DTXSID00727205, MWWJZKUPSAEIOT-UHFFFAOYSA-N, BCP14100, KS-00000Q2G, 1112AA, 3-Bromo-4-(trifluoromethoxy)anisole, ANW-52869, CL8600, MFCD20485915, ZINC81991200, AKOS015999912, AK-94376, DS-17965, AB0087452, AJ-124086, TC-141614, ST24022060, X-3690, C8H6BrF3O2, 2-BROMO-4-METHOXY-1-(TRIFLUOROMETHOXY) BENZENE,

Complexity	186
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	269.95g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	271.033g/mol
Monoisotopic Mass	269.95g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	18.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number