Home Other Building Blocks 5-[2-(Trifluoromethyl)phenyl]furfural

5-[2-(Trifluoromethyl)phenyl]furfural

CAS No.:
94098-56-3
Catalog Number:
AG003MB4
Molecular Formula:
C12H7F3O2
Molecular Weight:
240.1780
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Product Description
Catalog Number:
AG003MB4
Chemical Name:
5-[2-(Trifluoromethyl)phenyl]furfural
CAS Number:
94098-56-3
Molecular Formula:
C12H7F3O2
Molecular Weight:
240.1780
MDL Number:
MFCD00274240
IUPAC Name:
5-[2-(trifluoromethyl)phenyl]furan-2-carbaldehyde
InChI:
InChI=1S/C12H7F3O2/c13-12(14,15)10-4-2-1-3-9(10)11-6-5-8(7-16)17-11/h1-7H
InChI Key:
BECHPBVVELWRBW-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(o1)c1ccccc1C(F)(F)F
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.04g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.181g/mol
Monoisotopic Mass:
240.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties