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Home > Aldehydes > 1373348-95-8
1373348-95-8 | 4-[(6-chloropyridin-3-yl)methyl]benzaldehyde
CAS No: 1373348-95-8 Catalog No: AG00IU1S MDL No:MFCD22126117
Product Description
Catalog Number:
AG00IU1S
Chemical Name:
4-[(6-chloropyridin-3-yl)methyl]benzaldehyde
CAS Number:
1373348-95-8
Molecular Formula:
C13H10ClNO
Molecular Weight:
231.6776
MDL Number:
MFCD22126117
IUPAC Name:
4-[(6-chloropyridin-3-yl)methyl]benzaldehyde
InChI:
InChI=1S/C13H10ClNO/c14-13-6-5-12(8-15-13)7-10-1-3-11(9-16)4-2-10/h1-6,8-9H,7H2
InChI Key:
XNANGQYLMXGBOO-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)Cc1ccc(nc1)Cl
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.045g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.679g/mol
Monoisotopic Mass:
231.045g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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