AG009B4S

142738-94-1 | 3-(Trifluoromethoxy)anisole

AG009B4S

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CAS Number	142738-94-1
Catalog Number	AG009B4S(AGN-PC-0H0SKG)
Chemical Name	3-(Trifluoromethoxy)anisole
IUPAC Name	1-methoxy-3-(trifluoromethoxy)benzene
InChI	InChI=1S/C8H7F3O2/c1-12-6-3-2-4-7(5-6)13-8(9,10)11/h2-5H,1H3
InChI Key	OKSRAPDSZKICKZ-UHFFFAOYSA-N
MDL Number	MFCD01631504
Molecular Formula	C8H7F3O2
Molecular Weight	192.1352
SMILES	FC(F)(F)OC1=CC(OC)=CC=C1
Synonyms	3-(Trifluoromethoxy)anisole, 142738-94-1, 1-Methoxy-3-(trifluoromethoxy)Benzene, Benzene, 1-methoxy-3-(trifluoromethoxy)-, MFCD01631504, trifluoro(3-methoxyphenoxy)methane, PubChem4158, AC1MCRIX, 3-trifluoromethoxyanisole, ACMC-1C79Q, KSC494O1J, SCHEMBL1526052, SCHEMBL13322158, CTK3J4714, KS-00000ZAD, DTXSID70380407, OKSRAPDSZKICKZ-UHFFFAOYSA-N, JRD-1224, ZINC2382172, 1-methoxy-3-trifluoromethoxy-benzene, ANW-20720, CL8955, SBB091373, AKOS006228600, AM61311, AS04226, LF10316, MCULE-3068070821, RTR-005461, TRA0055727, VZ26124, 1-methoxy-3-(trifluoromethyloxy)benzene, AJ-34770, AN-31694, AS-46151, SC-54301, ST082983, AB0030831, ST2415380, TL8000945, TR-005461, FT-0643346, X3087, B-3049, A807957, I01-6790, 3- ANISOLE, C8H7F3O2, ZINC02382172, CID2777188,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.04g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	192.137g/mol
Monoisotopic Mass	192.04g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	18.5A^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	\N

Certificate of Analysis

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