AG003IRW

78725-46-9 | 3-(3-(Trifluoromethyl)phenoxy)benzaldehyde

AG003IRW

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CAS Number	78725-46-9
Catalog Number	AG003IRW(AGN-PC-0JSARG)
Chemical Name	3-(3-(Trifluoromethyl)phenoxy)benzaldehyde
EC Number	278-976-4
IUPAC Name	3-[3-(trifluoromethyl)phenoxy]benzaldehyde
InChI	InChI=1S/C14H9F3O2/c15-14(16,17)11-4-2-6-13(8-11)19-12-5-1-3-10(7-12)9-18/h1-9H
InChI Key	RPORRWJOHNQOHN-UHFFFAOYSA-N
MDL Number	MFCD00003356
Molecular Formula	C14H9F3O2
Molecular Weight	266.2153
SMILES	O=CC1=CC=CC(OC2=CC=CC(C(F)(F)F)=C2)=C1
Synonyms	3-[3-(Trifluoromethyl)phenoxy]benzaldehyde, 78725-46-9, 3-(3-(TRIFLUOROMETHYL)PHENOXY)BENZALDEHYDE, 3-(3-Trifluoromethylphenoxy)benzaldehyde, 3-(3'-(Trifluoromethyl)phenoxy)benzaldehyde, RPORRWJOHNQOHN-UHFFFAOYSA-N, 3-(3-[Trifluoromethyl]phenoxy)benzaldehyde, Benzaldehyde,3-[3-(trifluoromethyl)phenoxy]-, Benzaldehyde, 3-[3-(trifluoromethyl)phenoxy]-, EINECS 278-976-4, ACMC-1BGAL, AC1LAXA8, AC1Q4JB0, SCHEMBL417140, AC1Q4J12, CTK5E6045, RPORRWJOHNQOHN-UHFFFAOYSA-, ZINC56511, DTXSID70229261, MFCD00003356, AKOS001171579, MCULE-5603975425, NE42211, VZ26197, ZB001690, m-[m-(trifluoromethyl)phenoxy]benzaldehyde, 3-(3-trifluoromethyl phenoxy)-benzaldehyde, DB-008269, TC-169874, 3-[3-(trifluoromethyl)-phenoxy]benzaldehyde, CS-0060414, FT-0641690, ST50308315, EN300-21805, 3-{[3-(trifluoromethyl)phenyl]oxy}benzaldehyde, 3-(|A,|A,|A-Trifluoro-m-tolyloxy)benzaldehyde, 3-[3-(Trifluoromethyl)phenoxy]benzaldehyde, 97%, A839479, {3-[3-(trifluoromethyl)phenoxy]phenyl}formaldehyde, I01-18283, InChI=1/C14H9F3O2/c15-14(16,17)11-4-2-6-13(8-11)19-12-5-1-3-10(7-12)9-18/h1-9H, C14H9F3O2, 3-[3- PHENOXY]BENZALDEHYDE, C14-H9-F3-O2, CID522711, ZINC00056511, 3-(3'-trifluoromethyl)phenoxy)benzaldehyde,

Complexity	304
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	266.055g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	266.219g/mol
Monoisotopic Mass	266.055g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P261-P280-P305+P351+P338-P304+P340-P405-P501
Signal Words	warning
UN Code

Certificate of Analysis

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