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72178-85-9 | 3-(2-chlorophenoxy)benzaldehyde
CAS No: 72178-85-9 Catalog No: AG01DSU9 MDL No:MFCD09032024
Product Description
Catalog Number:
AG01DSU9
Chemical Name:
3-(2-chlorophenoxy)benzaldehyde
CAS Number:
72178-85-9
Molecular Formula:
C13H9ClO2
Molecular Weight:
232.6624
MDL Number:
MFCD09032024
IUPAC Name:
3-(2-chlorophenoxy)benzaldehyde
InChI:
InChI=1S/C13H9ClO2/c14-12-6-1-2-7-13(12)16-11-5-3-4-10(8-11)9-15/h1-9H
InChI Key:
MQUOQWHXKWQIAX-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)Oc1ccccc1Cl
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.029g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.663g/mol
Monoisotopic Mass:
232.029g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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