HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

N-(4-Fluorophenyl)-3-(trifluoromethyl)benzamide

HCID 531806
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
33489-71-3
Standard SMILES
O=C(Nc1ccc(F)cc1)c1cccc(C(F)(F)F)c1
InChIKey
SDBBNTCNOXEWLV-UHFFFAOYSA-N
Molecular formula
C14H9F4NO
Average molar mass
283.22 g/mol
Monoisotopic mass
283.06202656

Names & identifiers

Preferred name
N-(4-Fluorophenyl)-3-(trifluoromethyl)benzamide
IUPAC
N-(4-fluorophenyl)-3-(trifluoromethyl)benzamide
English name
N-4-Fluorophenyl-3-(trifluoromethyl)benzamide
Molecular formula
C14H9F4NO
Molecular weight
283.22

Names & synonyms

33489-71-3N-(4-fluorophenyl)-3-(trifluoromethyl)benzamide4'-Fluoro-3-(trifluoromethyl)benzanilideDTXSID901243812RefChem:827658DTXCID201674682668-955-1N-4-Fluorophenyl-3-(trifluoromethyl)benzamideMFCD00045089Benzamide, N-(4-fluorophenyl)-3-trifluoromethyl-SCHEMBL30739967STL071358
Show more names
5,10-dimethylbenzo[g]isoquinoline4'-FLUOROPHENYL-3-(TRIFLUOROMETHYL)BENZAMIDEN-(4-Fluorophenyl)-3-(trifluoromethyl)benzamide97%
AKOS000503533DB-048421CS-0323499ST45049932F009244N-(4-fluorophenyl)-3-(trifluoromethyl) benzamideZ27805866N-(4-fluorophenyl)[3-(trifluoromethyl)phenyl]carboxamide

Database identifiers

CAS
33489-71-3
PubChem CID
531806
DTXSID
DTXSID901243812
EC Number
668-955-1
Nikkaji
J3.305.071B

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
20
Formal charge
0
Complexity
337

Physicochemical properties

Melting point
101 · 101-102°C
Symbol(GHS)
7 · GHS07,GHS09
Signal word
Warning
Hazard statements
411 · H411-H319
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
Hazard Note
Irritant
HS Code
2942000090 · 2942000090

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P273, P280, P305+P351+P338, P337+P317, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesEye Irrit. 2 (100%)

Safety data

hs_code
2942000090
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07,GHS09
hazard_code
Xi
hazard_note
Irritant
safety_code
26-36
Hazard statements
H411-H319
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes