4-(Trifluoromethyl)benzylamine (HCID 76804)

Names & identifiers

Preferred name: 4-(Trifluoromethyl)benzylamine
IUPAC: [4-(trifluoromethyl)phenyl]methanamine
English name: 4-(Trifluoromethyl)benzylamine
Molecular formula: C8H8F3N
Molecular weight: 175.15

Names & synonyms

4-(Trifluoromethyl)benzylamine3300-51-4DTXSID60186637EINECS 221-971-9RefChem:517140DTXCID00109128221-971-9[4-(Trifluoromethyl)phenyl]methanamine4-(trifluoromethyl)benzyl amine(4-(trifluoromethyl)phenyl)methanamine4-Trifluoromethylbenzylamine1-[4-(trifluoromethyl)phenyl]methanamine

Show more names

PTF-BYMp-CF3-benzylamine4-(TrifluoromethyRARECHEM AL BW 00304-triMethylbenzylaMine4-AMINOMETHYLBENZOTRIFLUORIDE-(Trifluoromethyl)benzylamine4-(three fluoroMethyl)benzyl aMine

p-(Trifluoromethyl)benzylamineBenzenemethanamine, 4-(trifluoromethyl)-p-trifluoromethylbenzyl amineMFCD00010220[4-(trifluoromethyl)benzyl]aminep-trifluoromethylbenzylamine4-Trifluoromethyl-benzylaminePRDBLLIPPDOICK-UHFFFAOYSA-

Database identifiers

CAS: 3300-51-4
PubChem CID: 76804
DTXSID: DTXSID60186637
ChEMBL: CHEMBL274193
EC Number: 221-971-9
Nikkaji: J236.273B

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 1
Heavy atoms: 12
Formal charge: 0
Complexity: 136

Physicochemical properties

Melting point: 43 °C · 43 °C
Boiling point: 79 · 79-82 °C (15 mmHg)
Density: 1.229 g/mL · 1.229 g/mL at 25 °C (lit.)
refractive index: 20 · n20/D 1.464(lit.)
Flash point: 167 °F · 167 °F
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
pka: 8.6 · 8.60±0.10(Predicted)
form: Liquid
Specific Gravity: 1.229 · 1.229
color: Clear colorless to light yellow
Sensitive: Air Sensitive
BRN: 2640698 · 2640698
InChI: InChI=1S/C8H8F3N/c9-8(10,11)7-3-1-6(5-12)2-4-7/h1-4H,5,12H2
InChIKey: PRDBLLIPPDOICK-UHFFFAOYSA-N
SMILES: C1(CN)=CC=C(C(F)(F)F)C=C1
CAS DataBase Reference: 3300 · 3300-51-4(CAS DataBase Reference)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs: Respiratory system
PPE: Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes: Xi,C
Risk Statements: 36 · 36/37/38-34
Safety Statements: 26 · 26-36-45-36/37/39
RIDADR: 2735 · 2735
WGK Germany: 3 · 3
Hazard Note: Corrosive
HazardClass: 8 · 8
PackingGroup: III
HS Code: 29339900 · 29339900
Storage Class: 10 · 10 - Combustible liquids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
Limited Quantities: 5 L · 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H314 (18.8%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 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 CategoriesSkin Corr. 1C (18.8%)

Safety data

PPE: Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk: 3
ridadr: 2735
hs_code: 29339900
risk_code: 36/37/38-34
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi,C
hazard_note: Corrosive
safety_code: 26-36-45-36/37/39
hazard_class: 8
Storage Class: 10 - Combustible liquids
packing_group: III
target organs: Respiratory system
Hazard statements: H315-H319-H335
Limited Quantities: 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P264-P271-P280-P302+P352-P305+P351+P338