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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 2777048Generated: October 26, 2026

3,4,5-Trifluorobenzylamine

RARECHEM AL BW 0701 · 3,4,5-Trifluorobenzy · Trifluorobenzylamine 345- · 3,4,5-TRIFLUOROBENZYLAMINE · 3,4,5-Trifluorobenzylamine98% · 3,4,5-Trifluorobenzylamine 98% · 3,4,5-Trifluorobenzylamine,97% · 3,4,5-trifluorobenzyl aMine*HCl

https://huagongshe.com/en/chemical/2777048

3,4,5-Trifluorobenzylamine molecular structure

Identifiers & Physical Properties

CAS No.235088-69-4
Molecular formulaC7H6F3N
Average molar mass161.12 g/mol
Monoisotopic mass161.04523385 g/mol
SMILESNCc1cc(F)c(F)c(F)c1
InChIKeyAJGBQAAXUVSBCH-UHFFFAOYSA-N
PubChem CID2777048
EC No.671-907-2
DTXSIDDTXSID50380349

Chemical & Physical Properties

XLogP1.1
Topological polar surface area26
Hydrogen bond donors1
Hydrogen bond acceptors4
Rotatable bonds1
Heavy atoms11
Formal charge0
Complexity119
Boiling point176.3±35.0 °C(Predicted)
Density1.320±0.06 g/cm3(Predicted)
Refractive index1.4736
Storage conditionsunder inert gas (nitrogen or Argon) at 2–8 °C
pKa (acidity coefficient)8.49±0.10(Predicted)
Physical stateliquid
ColorClear, colourless
SensitivityAir Sensitive
InChI1S/C7H6F3N/c8-5-1-4(3-11)2-6(9)7(5)10/h1-2H,3,11H2
InChIKeyAJGBQAAXUVSBCH-UHFFFAOYSA-N
SMILESNCc1cc(F)c(F)c(F)c1
CAS DataBase Reference235088-69-4(CAS DataBase Reference)
UNSPSC Code12352116
NACRESNA.21
GHS pictogramGHS05
Signal wordWarning
GHS hazard statementsH314-H318
GHS precautionary statementsP260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a
Hazard symbolsXi
Risk statements (R)34
Safety statements (S)26-36/37/39-45
UN transport number2735
Water hazard class (WGK)WGK 3
Hazard NoteIrritant
Hazard class8
Packing groupII
Customs code2921490090
Storage class11 - Combustible Solids

Safety & Regulations

GHS classificationDangerH314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 7 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and CategoriesSkin Corr. 1B (100%)
Water hazard class (WGK)WGK 3
UN transport number2735
Customs code2921490090
Risk statements (R)34
Signal wordWarning
GHS pictogramGHS05
Hazard symbolsXi
hazard_noteIrritant
Safety statements (S)26-36/37/39-45
Hazard class8
Storage class11 - Combustible Solids
Packing groupII
GHS hazard statementsH314-H318
GHS precautionary statementsP260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a