AG000RZW

1261753-88-1 | Benzenamine, 4-nitro-2-(trifluoromethoxy)-

AG000RZW

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CAS Number	1261753-88-1
Catalog Number	AG000RZW(AGN-PC-0WA753)
Chemical Name	Benzenamine, 4-nitro-2-(trifluoromethoxy)-
IUPAC Name	4-nitro-2-(trifluoromethoxy)aniline
InChI	InChI=1S/C7H5F3N2O3/c8-7(9,10)15-6-3-4(12(13)14)1-2-5(6)11/h1-3H,11H2
InChI Key	FFDBXRVBNGKCDQ-UHFFFAOYSA-N
MDL Number	MFCD18399915
Molecular Formula	C7H5F3N2O3
Molecular Weight	222.1214
SMILES	NC1=C(OC(F)(F)F)C=C(C=C1)[N+]([O-])=O
Synonyms	4-Nitro-2-(trifluoromethoxy)aniline, 1261753-88-1, 2-trifluoromethoxy-4-nitroaniline, AK-61349, ACMC-209b28, SCHEMBL16923592, CTK8A9636, DTXSID20719925, WT028, ACT09420, KS-00000P2X, ANW-18606, MFCD18399915, ZINC82046506, 2-Amino-5-nitrotrifluoromethoxybenzene, CJ-22023, DS-14757, AJ-124201, AX8217296, TC-107351, Benzenamine, 4-nitro-2-(trifluoromethoxy)-, CS-0042015, ST24043941, Z9067, B-9245, C7H5F3N2O3,

Complexity	241
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.025g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	222.123g/mol
Monoisotopic Mass	222.025g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	81.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number