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4,5-Difluoro-2-methylaniline - 98%, high purity , CAS No.875664-57-6

COA

Grade & Purity:

≥98%

Cas Number: 875664-57-6
Molecular Weight: 143.14
MDL number: MFCD08062378
PubChem CID: 18727725
PubChem SID: 488199659

In stock

Item Number

D120701

Grouped product items
SKU	Size	Availability	Price
D120701-250mg	250mg	3	$138.90
D120701-1g	1g	3	$241.90
D120701-5g	5g	2	$687.90
D120701-25g	25g	3	$1,717.90
D120701-100g	100g	2	$3,434.90

Basic Description

Synonyms	4,5-Difluoro-2-methylaniline \| 875664-57-6 \| 2-Amino-4,5-difluorotoluene \| 4,5-DIFLUORO-O-TOLUIDINE \| MFCD08062378 \| 4,5-difluoro-2-methylbenzenamine \| 2-AMINO-4,5-DIFLUORO-TOLUENE \| SCHEMBL966908 \| DTXSID50595850 \| HKAMTWLPOCYTMX-UHFFFAOYSA-N \| (4,5-difluoro-2-methylphenyl)
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Toluenes
Intermediate Tree Nodes	Not available
Direct Parent	Aminotoluenes
Alternative Parents	Aniline and substituted anilines Fluorobenzenes Aryl fluorides Primary amines Organofluorides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Aminotoluene - Aniline or substituted anilines - Halobenzene - Fluorobenzene - Aryl halide - Aryl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as aminotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group and one amino 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

Pubchem Sid	488199659
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488199659
IUPAC Name	4,5-difluoro-2-methylaniline
INCHI	InChI=1S/C7H7F2N/c1-4-2-5(8)6(9)3-7(4)10/h2-3H,10H2,1H3
InChIKey	HKAMTWLPOCYTMX-UHFFFAOYSA-N
Smiles	CC1=CC(=C(C=C1N)F)F
Isomeric SMILES	CC1=CC(=C(C=C1N)F)F
Molecular Weight	143.14
Reaxy-Rn	34382160
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=34382160&ln=

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

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

Analytical Chart:

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7 results found

Lot Number	Certificate Type	Date	Item
H1611078	Certificate of Analysis	Apr 10, 2024	D120701
F2317917	Certificate of Analysis	Jul 03, 2023	D120701
B2225103	Certificate of Analysis	Jan 13, 2022	D120701
B2225114	Certificate of Analysis	Jan 13, 2022	D120701
B2225242	Certificate of Analysis	Jan 13, 2022	D120701
D2303598	Certificate of Analysis	Jan 13, 2022	D120701
L2413092	Certificate of Analysis	Jan 13, 2022	D120701

Chemical and Physical Properties

Solubility	not soluble in water
Boil Point(°C)	216.2°C at 760 mmHg
Melt Point(°C)	56-58°C
Molecular Weight	143.130 g/mol
XLogP3	1.800
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	143.055 Da
Monoisotopic Mass	143.055 Da
Topological Polar Surface Area	26.000 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	118.000
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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