AG00HV2I

137736-63-1 | Pyridine, 2-(4-bromophenoxy)-5-(trifluoromethyl)-

AG00HV2I

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CAS Number	137736-63-1
Catalog Number	AG00HV2I(AGN-PC-0KLPNL)
Chemical Name	Pyridine, 2-(4-bromophenoxy)-5-(trifluoromethyl)-
IUPAC Name	2-(4-bromophenoxy)-5-(trifluoromethyl)pyridine
InChI	InChI=1S/C12H7BrF3NO/c13-9-2-4-10(5-3-9)18-11-6-1-8(7-17-11)12(14,15)16/h1-7H
InChI Key	VBTDRWBKGIRTPQ-UHFFFAOYSA-N
MDL Number	MFCD00204096
Molecular Formula	C12H7BrF3NO
Molecular Weight	318.0893
SMILES	FC(c1cnc(Oc2ccc(Br)cc2)cc1)(F)F
Synonyms	2-(4-bromophenoxy)-5-(trifluoromethyl)pyridine, 137736-63-1, Pyridine, 2-(4-bromophenoxy)-5-(trifluoromethyl)-, 4-bromo-1-[5-(trifluoromethyl)(2-pyridyloxy)]benzene, AC1Q4JEU, Maybridge3_004140, AC1ME553, SCHEMBL9272113, CTK5I7621, KS-00000LRE, VBTDRWBKGIRTPQ-UHFFFAOYSA-N, HMS1442M04, ZINC169703, MFCD00204096, SBB054206, AKOS000202052, MCULE-4378382790, NE11379, IDI1_015527, AK411459, DS-18695, ST50949800, EN300-67522, Z54079189, ZINC00169703, CID2822057,

Complexity	267
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	316.966g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	318.093g/mol
Monoisotopic Mass	316.966g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	22.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number