3-(Trifluoromethyl)benzaldehyde
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Product Description
Product
3-(Trifluoromethyl)benzaldehyde
CAS
454-89-7
Formula
C8H5F3O
Synonym
3-Trifluoromethylbenzaldehyde; a a a-Trifluoro-m-tolualdehyde; a,a,a-trifluoro-3-tolualdehyde; alpha,alpha,alpha-Trifluoro-3-tolualdehyde; Benzaldehyde, 3-(trifluoromethyl)-; EINECS 207-228-1; m-Tolualdehyde, a,a,a-trifluoro-; m-Trifluoromethylbenzaldehyde; UNII-AT7H4H5U3E
Typical Product Specifications
Molecular weight
174.12
SMILES
O=Cc1cccc(C(F)(F)F)c1
InChI
1S/C8H5F3O/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-5H
InChIKey
NMTUHPSKJJYGML-UHFFFAOYSA-N
Water solubility
457 mg/L
log P (octanol-water)
2.47
Vapor Pressure
0.677 mm Hg
Atmospheric OH Rate Constant
1.70E-11 cm3/molecule-sec
Henry's Law Constant
1.17E-04 atm-m3/mole
Class
3-(Trifluoromethyl)benzaldehyde
Product Description
Product
3-(Trifluoromethyl)benzaldehyde
CAS
454-89-7
Formula
C8H5F3O
Synonym
3-Trifluoromethylbenzaldehyde; a a a-Trifluoro-m-tolualdehyde; a,a,a-trifluoro-3-tolualdehyde; alpha,alpha,alpha-Trifluoro-3-tolualdehyde; Benzaldehyde, 3-(trifluoromethyl)-; EINECS 207-228-1; m-Tolualdehyde, a,a,a-trifluoro-; m-Trifluoromethylbenzaldehyde; UNII-AT7H4H5U3E
Typical Product Specifications
Molecular weight
174.12
SMILES
O=Cc1cccc(C(F)(F)F)c1
InChI
1S/C8H5F3O/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-5H
InChIKey
NMTUHPSKJJYGML-UHFFFAOYSA-N
Water solubility
457 mg/L
log P (octanol-water)
2.47
Vapor Pressure
0.677 mm Hg
Atmospheric OH Rate Constant
1.70E-11 cm3/molecule-sec
Henry's Law Constant
1.17E-04 atm-m3/mole
Class
