AG0094BR

120381-42-2 | BenzenaMine, 5-fluoro-N-Methyl-2-nitro-

AG0094BR

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CAS Number	120381-42-2
Catalog Number	AG0094BR(AGN-PC-03VTLR)
Chemical Name	BenzenaMine, 5-fluoro-N-Methyl-2-nitro-
IUPAC Name	5-fluoro-N-methyl-2-nitroaniline
InChI	InChI=1S/C7H7FN2O2/c1-9-6-4-5(8)2-3-7(6)10(11)12/h2-4,9H,1H3
InChI Key	HDQNXIOVYVAKBX-UHFFFAOYSA-N
MDL Number	MFCD16744213
Molecular Formula	C7H7FN2O2
Molecular Weight	170.1411
SMILES	O=[N+](C1=CC=C(F)C=C1NC)[O-]
Synonyms	5-fluoro-N-methyl-2-nitroaniline, 120381-42-2, Benzenamine, 5-fluoro-N-methyl-2-nitro-, SCHEMBL503378, HDQNXIOVYVAKBX-UHFFFAOYSA-N, 4-fluoro-2-methylaminonitrobenzene, ZINC52119069, AKOS011663270, NE45205, (5-Fluoro-2-nitro-phenyl)-methyl-amine, CJ-20699, Z8229, I01-8581, C7H7FN2O2,

Complexity	171
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.049g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	170.143g/mol
Monoisotopic Mass	170.049g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	57.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

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