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Home > Aldehydes > 885963-06-4
885963-06-4 | [1,1'-Biphenyl]-4-carboxaldehyde,3'-chloro-4'-methyl-
CAS No: 885963-06-4 Catalog No: AG008BAI MDL No:
Product Description
Catalog Number:
AG008BAI
Chemical Name:
[1,1'-Biphenyl]-4-carboxaldehyde,3'-chloro-4'-methyl-
CAS Number:
885963-06-4
Molecular Formula:
C14H11ClO
Molecular Weight:
230.6895
IUPAC Name:
4-(3-chloro-4-methylphenyl)benzaldehyde
InChI:
InChI=1S/C14H11ClO/c1-10-2-5-13(8-14(10)15)12-6-3-11(9-16)4-7-12/h2-9H,1H3
InChI Key:
YLQRGFFHJZWGPM-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1ccc(c(c1)Cl)C
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.05g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.691g/mol
Monoisotopic Mass:
230.05g/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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