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1696642-52-0 | 2-(5-methyl-1,2,3,6-tetrahydropyridin-1-yl)pyrimidine-5-carbaldehyde
CAS No: 1696642-52-0 Catalog No: AG01C8QH MDL No:MFCD31443207
Product Description
Catalog Number:
AG01C8QH
Chemical Name:
2-(5-methyl-1,2,3,6-tetrahydropyridin-1-yl)pyrimidine-5-carbaldehyde
CAS Number:
1696642-52-0
Molecular Formula:
C11H13N3O
Molecular Weight:
203.2404
MDL Number:
MFCD31443207
IUPAC Name:
2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)pyrimidine-5-carbaldehyde
InChI:
InChI=1S/C11H13N3O/c1-9-3-2-4-14(7-9)11-12-5-10(8-15)6-13-11/h3,5-6,8H,2,4,7H2,1H3
InChI Key:
UTVGXOFSIYWYHZ-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(nc1)N1CCC=C(C1)C
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.245g/mol
Monoisotopic Mass:
203.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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