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1251232-40-2 | 1-(6-methylpyridin-2-yl)piperidine-4-carbaldehyde
CAS No: 1251232-40-2 Catalog No: AG01A6BI MDL No:MFCD16839038
Product Description
Catalog Number:
AG01A6BI
Chemical Name:
1-(6-methylpyridin-2-yl)piperidine-4-carbaldehyde
CAS Number:
1251232-40-2
Molecular Formula:
C12H16N2O
Molecular Weight:
204.2682
MDL Number:
MFCD16839038
IUPAC Name:
1-(6-methylpyridin-2-yl)piperidine-4-carbaldehyde
InChI:
InChI=1S/C12H16N2O/c1-10-3-2-4-12(13-10)14-7-5-11(9-15)6-8-14/h2-4,9,11H,5-8H2,1H3
InChI Key:
XBUHJHCKRPGPKB-UHFFFAOYSA-N
SMILES:
O=CC1CCN(CC1)c1cccc(n1)C
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.126g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.273g/mol
Monoisotopic Mass:
204.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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