AG00GY61

886499-93-0 | 4-Bromo-3-(trifluoromethoxy)phenol

AG00GY61

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CAS Number	886499-93-0
Catalog Number	AG00GY61(AGN-PC-01LREX)
Chemical Name	4-Bromo-3-(trifluoromethoxy)phenol
IUPAC Name	4-bromo-3-(trifluoromethoxy)phenol
InChI	InChI=1S/C7H4BrF3O2/c8-5-2-1-4(12)3-6(5)13-7(9,10)11/h1-3,12H
InChI Key	PGJZBAVEKVWHIO-UHFFFAOYSA-N
MDL Number	MFCD11110204
Molecular Formula	C7H4BrF3O2
Molecular Weight	257.0047
SMILES	OC1=CC=C(Br)C(OC(F)(F)F)=C1
Synonyms	4-Bromo-3-(trifluoromethoxy)phenol, 886499-93-0, MFCD06660164, SCHEMBL1978168, CTK7B7291, DTXSID20590675, PGJZBAVEKVWHIO-UHFFFAOYSA-N, JRD-1492, ZX-RL006977, 4532AC, ANW-61092, SBB101803, ZINC12359284, AKOS015956920, FCH1325688, 4-bromo-3-[(trifluoromethyl)oxy]phenol, AJ-61442, BC005219, DS-14998, PC499006, AX8217660, ST2411192, TC-149837, CS-0084332, C7H4BrF3O2,

Complexity	174
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	255.935g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	257.006g/mol
Monoisotopic Mass	255.935g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number