2-Chloro-5-(trifluoromethyl)benzylamine (HCID 2736682)

Names & identifiers

Preferred name: 2-Chloro-5-(trifluoromethyl)benzylamine
IUPAC: [2-chloro-5-(trifluoromethyl)phenyl]methanamine
English name: 2-Chloro-5-trifluoromethylbenzyl chloride
Molecular formula: C8H7ClF3N
Molecular weight: 209.6

Names & synonyms

2-Chloro-5-(trifluoromethyl)benzylamine15996-78-8DTXSID00371525RefChem:258901DTXCID20322559624-271-5[2-chloro-5-(trifluoromethyl)phenyl]methanamine2-chloro-5-(trifluoromethyl)benzyl amineMFCD00190123(2-chloro-5-(trifluoromethyl)phenyl)methanamineBenzenemethanamine, 2-chloro-5-(trifluoromethyl)-[2-chloro-5-(trifluoromethyl)phenyl]methylamine

Show more names

RARECHEM AL BW 0385Chlorotrifluoromethylbenzylamine 25()---2-Chloro-5-trifluoromethylbenzyl chloride2-Chloro-5-(trifluoromethyl)benzylamine98%2-Chloro-5-(trifluoromethyl)benzylamine 98%2-Chloro-5-(trifluoromethyl)benzylamine, 97+%(2-Chloro-5-(trifluoroMethyl) phenyl) MethanaMine

2-chloro-5-trifluoromethyl-benzylamine1-[2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL]METHANAMINESCHEMBL856434SCHEMBL6152782SBB028422AKOS015850171PS-8024SB78647

Database identifiers

CAS: 15996-78-8
PubChem CID: 2736682
DTXSID: DTXSID00371525
EC Number: 624-271-5

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 171

Physicochemical properties

Boiling point: 90 · 90-94°C 13mm
Density: 1.338 g/mL · 1.338 g/mL at 25 °C
refractive index: 20 · n 20/D 1.489
Flash point: 218 °F · 218 °F
pka: 8.15 · 8.15±0.10(Predicted)
form: liquid
color: Clear, almost colourless
Sensitive: Air Sensitive
BRN: 2835666 · 2835666
InChI: 1S/C8H7ClF3N/c9-7-2-1-6(8(10,11)12)3-5(7)4-13/h1-3H,4,13H2
InChIKey: XOCMZYUQWVACMA-UHFFFAOYSA-N
SMILES: NCc1cc(ccc1Cl)C(F)(F)F
CAS DataBase Reference: 15996 · 15996-78-8(CAS DataBase Reference)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 6 · GHS06
Signal word: Danger
Hazard statements: 301 · H301-H315-H317-H319
Precautionary statements: 280 · P280-P301+P310+P330-P302+P352-P305+P351+P338
PPE: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes: T,C,Xi
Risk Statements: 25 · 25-36/38-43-36
Safety Statements: 26 · 26-36/37-45
RIDADR: 2810 · UN 2810 6.1/PG 3
WGK Germany: 3 · 3
Hazard Note: Corrosive
HazardClass: 8 · 8
HS Code: 2921490090 · 2921490090
Storage Class: 6.1 C · 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
Hazard Classifications: 3 OralEye · Acute Tox. 3 OralEye Irrit. 2Skin Irrit. 2Skin Sens. 1
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

H301 (86.7%): Toxic if swallowed [Danger Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P272, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 3 (86.7%)

Safety data

PPE: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
wgk: 3
ridadr: UN 2810 6.1/PG 3
hs_code: 2921490090
risk_code: 25-36/38-43-36
Signal word: Danger
Symbol(GHS): GHS06
hazard_code: T,C,Xi
hazard_note: Corrosive
safety_code: 26-36/37-45
hazard_class: 8
Storage Class: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
Hazard statements: H301-H315-H317-H319
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: Acute Tox. 3 OralEye Irrit. 2Skin Irrit. 2Skin Sens. 1
Precautionary statements: P280-P301+P310+P330-P302+P352-P305+P351+P338