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Basic Information
CAS No.: 67515-60-0
Name: 4-Fluoro-3-(trifluoromethyl)benzaldehyde
Article Data: 3
Molecular Structure:
Molecular Structure of 67515-60-0 (4-Fluoro-3-(trifluoromethyl)benzaldehyde)
Formula: C8H4F4O
Molecular Weight: 192.113
Synonyms: 3-Trifluoromethyl-4-fluorobenzaldehyde;4-Fluoro-3-trifluoromethylbenzaldehyde;4-Fluoro-5-(trifluoromethyl)benzaldehyde;a,a,a,4-Tetrafluoro-m-tolylaldehyde;4-Fluoro-3-(trifluoromethyl)benzaldehyde;
EINECS: -0
Density: 1.383 g/cm3
Melting Point: 114.0-116.0oC
Boiling Point: 191 °C at 760 mmHg
Flash Point: 70.4 °C
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36
PSA: 17.07000
LogP: 2.65700
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Chemistry

Product Name: Benzaldehyde, 4-fluoro-3-(trifluoromethyl)- (CAS NO.67515-60-0)

Molecular Formula: C8H4F4O
Molecular Weight: 192.11g/mol
Mol File: 67515-60-0.mol
Sensitive: Air Sensitive
Index of Refraction: 1.459 
Molar Refractivity: 37.97 cm3 
Molar Volume: 138.8 cm3  
Surface Tension: 27 dyne/cm 
Density: 1.383 g/cm3 
Flash Point: 70.4 °C 
Enthalpy of Vaporization: 42.72 kJ/mol 
Boiling Point: 191 °C at 760 mmHg 
Vapour Pressure: 0.526 mmHg at 25°C
XLogP3-AA: 2.4
H-Bond Donor: 0
H-Bond Acceptor: 5
Structure Descriptors of Benzaldehyde, 4-fluoro-3-(trifluoromethyl)- (CAS NO.67515-60-0):
  IUPAC Name: 4-fluoro-3-(trifluoromethyl)benzaldehyde
  Canonical SMILES: C1=CC(=C(C=C1C=O)C(F)(F)F)F
  InChI: InChI=1S/C8H4F4O/c9-7-2-1-5(4-13)3-6(7)8(10,11)12/h1-4H 
  InChIKey: BIUDHHGROGJSHN-UHFFFAOYSA-N
Product Categories: Aromatic Aldehydes & Derivatives (substituted); Benzaldehyde; Aldehydes; C8; Carbonyl Compounds

Safety Profile

Safety Information of Benzaldehyde, 4-fluoro-3-(trifluoromethyl)- (CAS NO.67515-60-0):
Hazard Codes: XiIrritant
Risk Statements: 36/37/38  
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing.
WGK Germany: 3
Hazard Note: Irritant
HazardClass: IRRITANT

Specification

 Benzaldehyde, 4-fluoro-3-(trifluoromethyl)- , its CAS NO. is 67515-60-0, the synonyms are 4-Fluoro-3-(trifluoromethyl)benzaldehyde ; 3-Trifluoromethyl-4-fluorobenzaldehyde .