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Home > Aldehydes > 185244-97-7
185244-97-7 | 3-Pyridinecarboxaldehyde, 2-chloro-5-(4-methoxyphenyl)-
CAS No: 185244-97-7 Catalog No: AG007TLH MDL No:
Product Description
Catalog Number:
AG007TLH
Chemical Name:
3-Pyridinecarboxaldehyde, 2-chloro-5-(4-methoxyphenyl)-
CAS Number:
185244-97-7
Molecular Formula:
C13H10ClNO2
Molecular Weight:
247.6770
IUPAC Name:
2-chloro-5-(4-methoxyphenyl)pyridine-3-carbaldehyde
InChI:
InChI=1S/C13H10ClNO2/c1-17-12-4-2-9(3-5-12)10-6-11(8-16)13(14)15-7-10/h2-8H,1H3
InChI Key:
SRVKUMXTLCFSAX-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1cnc(c(c1)C=O)Cl
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.04g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.678g/mol
Monoisotopic Mass:
247.04g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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