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5-Fluoro-2-methyl-3-nitroaniline - 95%, high purity , CAS No.168770-44-3

COA

Grade & Purity:

≥95%

Cas Number: 168770-44-3
Molecular Weight: 170.14
PubChem CID: 18465377

In stock

Item Number

F191443

Grouped product items
SKU	Size	Availability	Price	Qty
F191443-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$152.90
F191443-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$362.90

Discover 5-Fluoro-2-methyl-3-nitroaniline by Aladdin Scientific in 95% for only $152.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	5-Fluoro-2-methyl-3-nitroaniline \| 168770-44-3 \| Benzenamine, 5-fluoro-2-methyl-3-nitro- \| 5-FLUORO-3-NITRO-2-METHYLANILINE \| SCHEMBL4748374 \| 2-amino-4-fluoro-6-nitrotoluene \| AMY7262 \| DTXSID60594112 \| XWXBFFACZMFPHH-UHFFFAOYSA-N \| 2-amino-4-fluoro-6-nitro-toluene \| AKOS00
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Nitrobenzenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Nitrobenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Nitrobenzenes
Alternative Parents	Nitrotoluenes Nitroaromatic compounds Aniline and substituted anilines Aminotoluenes Fluorobenzenes Aryl fluorides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Primary amines Organofluorides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Nitrobenzene - Nitrotoluene - Nitroaromatic compound - Aniline or substituted anilines - Aminotoluene - Fluorobenzene - Halobenzene - Toluene - Aryl halide - Aryl fluoride - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxide - Organonitrogen compound - Organofluoride - Primary amine - Organohalogen compound - Amine - Organic zwitterion - Organic oxygen compound - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	5-fluoro-2-methyl-3-nitroaniline
INCHI	InChI=1S/C7H7FN2O2/c1-4-6(9)2-5(8)3-7(4)10(11)12/h2-3H,9H2,1H3
InChIKey	XWXBFFACZMFPHH-UHFFFAOYSA-N
Smiles	CC1=C(C=C(C=C1[N+](=O)[O-])F)N
Isomeric SMILES	CC1=C(C=C(C=C1[N+](=O)[O-])F)N
Molecular Weight	170.14
Reaxy-Rn	13574844
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13574844&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	170.140 g/mol
XLogP3	1.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	170.049 Da
Monoisotopic Mass	170.049 Da
Topological Polar Surface Area	71.800 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	183.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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