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139502-80-0 | [1,1'-Biphenyl]-3-carboxaldehyde, 4'-chloro-
CAS No: 139502-80-0 Catalog No: AG001B5A MDL No:MFCD03424622
Product Description
Catalog Number:
AG001B5A
Chemical Name:
[1,1'-Biphenyl]-3-carboxaldehyde, 4'-chloro-
CAS Number:
139502-80-0
Molecular Formula:
C13H9ClO
Molecular Weight:
216.6630
MDL Number:
MFCD03424622
IUPAC Name:
3-(4-chlorophenyl)benzaldehyde
InChI:
InChI=1S/C13H9ClO/c14-13-6-4-11(5-7-13)12-3-1-2-10(8-12)9-15/h1-9H
InChI Key:
JIBHWLKAALCSRU-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)c1ccc(cc1)Cl
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.034g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.664g/mol
Monoisotopic Mass:
216.034g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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