CAS 2357-47-3 4-Fluoro-3-(trifluoromethyl)aniline (HCID 75377)

Names & identifiers

Preferred name: 4-Fluoro-3-(trifluoromethyl)aniline
IUPAC: 4-fluoro-3-(trifluoromethyl)aniline
English name: 4-Fluoro-3-(trifluoromethyl)aniline
Molecular formula: C7H5F4N
Molecular weight: 179.11

Names & synonyms

4-Fluoro-3-(trifluoromethyl)aniline2357-47-35-Amino-2-fluorobenzotrifluorideBenzenamine, 4-fluoro-3-(trifluoromethyl)-3-Trifluoromethyl-4-fluoroanilinealpha,alpha,alpha,4-Tetrafluoro-m-toluidine4-Fluoro-3-(trifluoromethyl)benzenamineEINECS 219-095-7UNII-V5584X2CTLV5584X2CTL2-Fluoro-5-aminobenzotrifluoride3-amino-6-fluorobenzotrifluoride

Show more names

BUTTPARK 45\03-724-Fluoro-3-(trifluor2-Fluoro-5-aminotrifluoride5-Amino-2-Fluorobenzotrifluori3-TrifluoroMethyl-4-fluoroa...α,α,α,4-Tetrafluoro-m-toluidine5-AMINO-2-FLUOROBENZTRIFLUORIDE2-Fluoro-2-aminobenzotrifluoride

4-fluoro-3-trifluoromethylphenylamineNSC-10326alpha,alpha,alpha-4-Tetrafluoro-m-toluidineDTXSID1022184PGFQDLOMDIBAPY-UHFFFAOYSA-NSC 10326m-Toluidine, .alpha.,.alpha.,.alpha.,4-tetrafluoro-3-TRIFLUOROMETHYL-4-FLUOROPHENYLAMINE

Database identifiers

CAS: 2357-47-3
PubChem CID: 75377
DTXSID: DTXSID1022184
UNII: V5584X2CTL
EC Number: 219-095-7
Nikkaji: J149.966A

Properties

Computed structural properties

XLogP: 2.2
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 0
Heavy atoms: 12
Formal charge: 0
Complexity: 156

Physicochemical properties

Boiling point: 207 · 207-208 °C (lit.)
Density: 1.393 g/mL · 1.393 g/mL at 25 °C (lit.)
refractive index: 20 · n20/D 1.466(lit.)
Flash point: 197 °F · 197 °F
storage temp.: 2 · 2-8°C
solubility: Chloroform (Slightly), Methanol (Slightly)
form: Oil
pka: 3.43 · 3.43±0.10(Predicted)
color: Colourless
Specific Gravity: 1.41 · 1.41
BRN: 641587 · 641587
InChI: InChI=1S/C7H5F4N/c8-6-2-1-4(12)3-5(6)7(9,10)11/h1-3H,12H2
InChIKey: PGFQDLOMDIBAPY-UHFFFAOYSA-N
SMILES: C1(N)=CC=C(F)C(C(F)(F)F)=C1
CAS DataBase Reference: 2357 · 2357-47-3(CAS DataBase Reference)
FDA UNII: 5584 X2CTL · V5584X2CTL
NIST Chemistry Reference: 4 · Benzenamine, 4-fluoro-3-(trifluoromethyl)-(2357-47-3)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302+H312+H332-H315-H319-H335
Precautionary statements: 261 · P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338
target organs: Respiratory system
PPE: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes: Xn,Xi,T
Risk Statements: 20 · 20/21/22-36/37/38-23-21/22
Safety Statements: 26 · 26-36-45-36/37/39
RIDADR: 2811 · 2811
WGK Germany: 3 · 3
Hazard Note: Irritant
HazardClass: 6.1 · 6.1
HS Code: 29214300 · 29214300
Storage Class: 10 · 10 - Combustible liquids
Hazard Classifications: 4 DermalAcute · Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

PPE: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
wgk: 3
ridadr: 2811
hs_code: 29214300
risk_code: 20/21/22-36/37/38-23-21/22
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xn,Xi,T
hazard_note: Irritant
safety_code: 26-36-45-36/37/39
hazard_class: 6.1
Storage Class: 10 - Combustible liquids
target organs: Respiratory system
Hazard statements: H302+H312+H332-H315-H319-H335
Hazard Classifications: Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338

Chemistry & industry

Applications

Uses4-Fluoro-3-(trifluoromethyl)aniline was used in the synthesis of well-defined rod-coil block copolymers of trifluoromethylated poly(phenylene oxide).