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680215-60-5 | 5-[2,6-DICHLORO-4-(TRIFLUOROMETHYL)PHENYL]-2-FURALDEHYDE
CAS No: 680215-60-5 Catalog No: AG005NWP MDL No:MFCD00278526
Product Description
Catalog Number:
AG005NWP
Chemical Name:
5-[2,6-DICHLORO-4-(TRIFLUOROMETHYL)PHENYL]-2-FURALDEHYDE
CAS Number:
680215-60-5
Molecular Formula:
C12H5Cl2F3O2
Molecular Weight:
309.0681
MDL Number:
MFCD00278526
IUPAC Name:
5-[2,6-dichloro-4-(trifluoromethyl)phenyl]furan-2-carbaldehyde
InChI:
InChI=1S/C12H5Cl2F3O2/c13-8-3-6(12(15,16)17)4-9(14)11(8)10-2-1-7(5-18)19-10/h1-5H
InChI Key:
QNYCADSCMMHYJB-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(o1)c1c(Cl)cc(cc1Cl)C(F)(F)F
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.962g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.065g/mol
Monoisotopic Mass:
307.962g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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