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  • 2,4-Difluoroaniline
Name:2,4-Difluoroaniline
CAS No:367-25-9

PRODUCT DESCRIPTION

【Name】
2,4-Difluoroaniline
【Iupac name】
2,4-difluoroaniline
【CAS Registry number】
367-25-9
【Synonyms】
2,4-Difluorobenzenamine
Difluoroaniline
1-Amino-2,4-difluorobenzene
【EINECS(EC#)】
206-687-5
【Molecular Formula】
C6H5F2N (Products with the same molecular formula)
【Molecular Weight】
129.11
【Inchi】
InChI=1/C6H5F2N/c7-4-1-2-6(9)5(8)3-4/h1-3H,9H2
【InChIKey】
CEPCPXLLFXPZGW-UHFFFAOYSA-N
【Canonical SMILES】
C1=CC(=C(C=C1F)F)N
【MOL File】
367-25-9.mol

Chemical and Physical Properties

【Appearance】
clear liquid
【Density】
1.268
【Melting Point】
-7.5℃
【Boiling Point】
170℃ (753 torr)
【Refractive Index】
1.5025-1.5075
【Flash Point】
62℃
【Water】
1-5 g/100 mL at 20.55℃
【Solubilities】
Insoluble
【Stability】
Stable. Combustible. Incompatible with strong oxidizing agents, acids, acid chlorides, acid anhydrides.
【HS Code】
29214210
【Storage temp】
Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
【Computed Properties】
Molecular Weight:129.107406 [g/mol]
Molecular Formula:C6H5F2N
XLogP3:1.5
H-Bond Donor:1
H-Bond Acceptor:3
Rotatable Bond Count:0
Exact Mass:129.039006
MonoIsotopic Mass:129.039006
Topological Polar Surface Area:26
Heavy Atom Count:9
Formal Charge:0
Complexity:97.1
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Donor Count:1
Feature 3D Cation Count:1
Feature 3D Ring Count:1
Effective Rotor Count:0
Conformer Sampling RMSD:0.4
CID Conformer Count:1

Safety and Handling

【Hazard Codes】
Xn:Harmful
【Risk Statements】
R20/21/22;R36/37/38
【Safety Statements 】
S26;S36/37/39
【HazardClass】
6.1
【Hazard Note】

Toxic

【Safety】

Hazard Codes of 2,4-Difluoroaniline (CAS NO.367-25-9):?HarmfulXn,ToxicT,IrritantXi 
Risk Statements: 20/21/22-36/37/38?
R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.?
R36/37/38: Irritating to eyes, respiratory system and skin. 
Safety Statements: 28-36/37/39-26?
S28: After contact with skin, wash immediately with plenty of soap-suds.?
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.?
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
RIDADR: UN 2941 6.1/PG 3
WGK Germany: 1
RTECS: BX3680000
F: 8-9-23 
Hazard Note: Toxic 
TSCA: T 
HazardClass: 6.1 
PackingGroup: III 
HS Code 29214210 
Mutation data reported. When heated to decomposition it emits toxic vapors of NOx and F?.

【PackingGroup 】
III
【Transport】
230kgs
【Report】

Reported in EPA TSCA Inventory.

Use and Manufacturing

【Usage】

Substance is used in organic syntheses.

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