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Home > Aldehydes > 131231-24-8
131231-24-8 | Benzaldehyde, 3-(3-pyridinyl)-
CAS No: 131231-24-8 Catalog No: AG000VRB MDL No:MFCD02684104
Product Description
Catalog Number:
AG000VRB
Chemical Name:
Benzaldehyde, 3-(3-pyridinyl)-
CAS Number:
131231-24-8
Molecular Formula:
C12H9NO
Molecular Weight:
183.2060
MDL Number:
MFCD02684104
IUPAC Name:
3-pyridin-3-ylbenzaldehyde
InChI:
InChI=1S/C12H9NO/c14-9-10-3-1-4-11(7-10)12-5-2-6-13-8-12/h1-9H
InChI Key:
UJPFNRWGFPAZMO-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)c1cccnc1
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.068g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.21g/mol
Monoisotopic Mass:
183.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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