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52130-34-4 | 5-(3,4-Dichlorophenyl)furfural
CAS No: 52130-34-4 Catalog No: AG003M4C MDL No:MFCD00448045
Product Description
Catalog Number:
AG003M4C
Chemical Name:
5-(3,4-Dichlorophenyl)furfural
CAS Number:
52130-34-4
Molecular Formula:
C11H6Cl2O2
Molecular Weight:
241.0701
MDL Number:
MFCD00448045
IUPAC Name:
5-(3,4-dichlorophenyl)furan-2-carbaldehyde
InChI:
InChI=1S/C11H6Cl2O2/c12-9-3-1-7(5-10(9)13)11-4-2-8(6-14)15-11/h1-6H
InChI Key:
PSQLTDROSWBPGT-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(o1)c1ccc(c(c1)Cl)Cl
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.974g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.067g/mol
Monoisotopic Mass:
239.974g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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