AG007QI8

121307-27-5 | 4-Ethoxy-2-(trifluoromethyl)aniline

AG007QI8

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CAS Number	121307-27-5
Catalog Number	AG007QI8(AGN-PC-0PFL54)
Chemical Name	4-Ethoxy-2-(trifluoromethyl)aniline
IUPAC Name	4-ethoxy-2-(trifluoromethyl)aniline
InChI	InChI=1S/C9H10F3NO/c1-2-14-6-3-4-8(13)7(5-6)9(10,11)12/h3-5H,2,13H2,1H3
InChI Key	ITILAORUYLLCNC-UHFFFAOYSA-N
MDL Number	MFCD08687760
Molecular Formula	C9H10F3NO
Molecular Weight	205.1770
SMILES	NC1=CC=C(OCC)C=C1C(F)(F)F
Synonyms	4-ethoxy-2-(trifluoromethyl)aniline, 121307-27-5, Benzenamine,4-ethoxy-2-(trifluoromethyl)-, ACMC-1C5ZH, AC1Q35ZU, SCHEMBL4230857, CTK4B2299, DTXSID70616334, 1110AD, ZINC14630311, AKOS000214998, MCULE-2303372765, RTR-003487, TR-003487, BB 0260699, FT-0678065, EN300-55733, Z-1295, Z857666912, C9H10F3NO, Benzenamine, 4-ethoxy-2-(trifluoromethyl)- (9CI),

Complexity	183
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.071g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	205.18g/mol
Monoisotopic Mass	205.071g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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