AG0076OA

1214323-39-3 | 2-Bromo-3-(trifluoromethyl)phenol

AG0076OA

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CAS Number	1214323-39-3
Catalog Number	AG0076OA(AGN-PC-03N85M)
Chemical Name	2-Bromo-3-(trifluoromethyl)phenol
IUPAC Name	2-bromo-3-(trifluoromethyl)phenol
InChI	InChI=1S/C7H4BrF3O/c8-6-4(7(9,10)11)2-1-3-5(6)12/h1-3,12H
InChI Key	MMCHLKGIGWXAIF-UHFFFAOYSA-N
MDL Number	MFCD13194487
Molecular Formula	C7H4BrF3O
Molecular Weight	241.0053
SMILES	OC1=CC=CC(C(F)(F)F)=C1Br
Synonyms	2-Bromo-3-(trifluoromethyl)phenol, 1214323-39-3, ACMC-209aa6, SCHEMBL1854326, CTK8A9443, DTXSID60624201, ZX-RL006973, ANW-17596, CB-659, MFCD13194487, ZINC85471898, AKOS016012225, FCH1382139, MB13472, PC499001, AJ-127818, AX8246991, TC-106341, FT-0721288, Z8300, C7H4BrF3O,

Complexity	159
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	239.94g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	241.007g/mol
Monoisotopic Mass	239.94g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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