CAS 67515-74-6 [4-Fluoro-3-(trifluoromethyl)phenyl]methanamine (HCID 522270)

Names & identifiers

Preferred name: [4-Fluoro-3-(trifluoromethyl)phenyl]methanamine
IUPAC: [4-fluoro-3-(trifluoromethyl)phenyl]methanamine
English name: 4-Fluoro-3-(trifluoromethyl)benzylamine
Molecular formula: C8H7F4N
Molecular weight: 193.14

Names & synonyms

(4-Fluoro-3-(trifluoromethyl)phenyl)methanamine[4-Fluoro-3-(trifluoromethyl)phenyl]methanamineRefChem:402828671-097-067515-74-64-Fluoro-3-(trifluoromethyl)benzylamine4-Fluoro-3-(trifluoromethyl)benzyl amineMFCD00070814[4-fluoro-3-(trifluoromethyl)phenyl]methylamine1-[4-fluoro-3-(trifluoromethyl)phenyl]methanamineBenzenemethanamine, 4-fluoro-3-(trifluoromethyl)-4-fluoro-3-trifluoromethyl-benzylamine

Show more names

RARECHEM AL BW 06705-(Aminomethyl)-2-fluorobenzotrifluoride4-Fluoro-3-(trifluoromethyl)benzylamine97%4-Fluoro-3-(trifluoromethyl)benzylamine 97%((4-Fluoro-3-(trifluoromethyl)phenyl)methyl)amine

SCHEMBL41768SCHEMBL41769DTXSID703349053-trifluoromethyl-4-fluorobenzylamineCK2417SBB091544AKOS0091591974-Fluoro3-(trifluoromethyl)benzylamine

Database identifiers

CAS: 67515-74-6
PubChem CID: 522270
DTXSID: DTXSID70334905
EC Number: 671-097-0

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 168

Physicochemical properties

Boiling point: 101 °C · 101°C 3mm
Density: 1.312 · 1.312
refractive index: 1.456 · 1.456
Flash point: 101 °C/3mm · 101°C/3mm
storage temp.: 2 · Keep in dark place,Inert atmosphere,2-8°C
pka: 8 · 8+-.0.10(Predicted)
form: solid
Appearance: Light yellow to yellow Solid
Sensitive: Air Sensitive
BRN: 3083164 · 3083164
InChI: 1S/C8H7F4N/c9-7-2-1-5(4-13)3-6(7)8(10,11)12/h1-3H,4,13H2
InChIKey: HZDVQEUISWBXPV-UHFFFAOYSA-N
SMILES: NCc1ccc(F)c(c1)C(F)(F)F
CAS DataBase Reference: 67515 · 67515-74-6(CAS DataBase Reference)
UNSPSC Code: 12352116 · 12352116
NACRES: 21 · NA.21
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314-H318
Precautionary statements: 260 h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a · P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a
Hazard Codes: C,Xi
Risk Statements: 34 · 34
Safety Statements: 26 · 26-36/37/39
RIDADR: 2735 · 2735
WGK Germany: 3 · WGK 3
Hazard Note: Corrosive/Store under nitrogen
HazardClass: IRRITANT
PackingGroup: III
HS Code: 2921490090 · 2921490090
Storage Class: 11 · 11 - Combustible Solids
Limited Quantities: 5 kg · 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 · 5 items

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H335 (16.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesSkin Corr. 1B (100%)；STOT SE 3 (16.7%)

Safety data

wgk: WGK 3
ridadr: 2735
hs_code: 2921490090
risk_code: 34
Signal word: Danger
Symbol(GHS): GHS05
hazard_code: C,Xi
hazard_note: Corrosive/Store under nitrogen
safety_code: 26-36/37/39
hazard_class: 8
Storage Class: 11 - Combustible Solids
packing_group: III
Hazard statements: H314-H318
Limited Quantities: 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Precautionary statements: P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a