2,4-Difluoroaniline - CAS 367-25-9
Catalog: |
BB023048 |
Product Name: |
2,4-Difluoroaniline |
CAS: |
367-25-9 |
Synonyms: |
Benzenamine, 2,4-difluoro-; 2,4-Difluorobenzenamine; Aniline, 2,4-difluoro-; 2,4-Difluorophenylamine; NSC 10297 |
IUPAC Name: | 2,4-difluoroaniline |
Molecular Weight: | 129.11 |
Molecular Formula: | C6H5F2N |
Canonical SMILES: | C1=CC(=C(C=C1F)F)N |
InChI: | InChI=1S/C6H5F2N/c7-4-1-2-6(9)5(8)3-4/h1-3H,9H2 |
InChI Key: | CEPCPXLLFXPZGW-UHFFFAOYSA-N |
Boiling Point: | 170°C |
Melting Point: | -7.5°C |
Flash Point: | 145 °F |
Purity: | ≥95% |
Density: | 1.289±0.06 g/cm3 |
Appearance: | Dark Reddish-purple Liquid |
MDL: | MFCD00007648 |
LogP: | 2.12820 |
GHS Hazard Statement: | H302 (98.11%): Harmful if swallowed [Warning Acute toxicity, oral]; H311 (92.45%): Toxic in contact with skin [Danger Acute toxicity, dermal]; H315 (15.09%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (13.21%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H331 (92.45%): Toxic if inhaled [Danger Acute toxicity, inhalation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113429757-A | Biodegradable anti-fogging master batch for mulching film and preservative film | 20210708 |
CN-113149234-A | Biochemical treatment method of fluoroaniline compound wastewater under high-salt impact condition | 20210425 |
CN-113116882-A | Application of naphthofuran o-quinone compound in preparation of antibacterial drugs | 20210326 |
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CN-112608275-A | Application of 2, 8-bis (trifluoromethyl) -4-hydroxyquinoline derivative in preparation and prevention and treatment of agricultural diseases | 20201229 |
PMID | Publication Date | Title | Journal |
22161134 | 20120701 | Subacute toxicity assessment of water disinfection byproducts on zebrafish | Pathology oncology research : POR |
22481173 | 20120701 | Vibronic and cation spectroscopy of 2,4-difluoroaniline | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
22552929 | 20120601 | Preformulation study of NSC-726796 | AAPS PharmSciTech |
22347036 | 20120201 | Ethyl 2-[(2,4-difluoro-phen-yl)hydrazinyl-idene]-3-oxobutano-ate | Acta crystallographica. Section E, Structure reports online |
21522320 | 20110202 | 3-(2,4-Difluoro-anilino)-9-nitro-dibenzo[b,e]oxepin-11(6H)-one | Acta crystallographica. Section E, Structure reports online |
Complexity: | 97.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 129.03900549 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 129.03900549 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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