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Home > Aldehydes > 1541978-59-9
1541978-59-9 | 6-(1-oxo-1lambda4-thiomorpholin-4-yl)pyridine-3-carbaldehyde
CAS No: 1541978-59-9 Catalog No: AG01C8L8 MDL No:MFCD23952533
Product Description
Catalog Number:
AG01C8L8
Chemical Name:
6-(1-oxo-1lambda4-thiomorpholin-4-yl)pyridine-3-carbaldehyde
CAS Number:
1541978-59-9
Molecular Formula:
C10H12N2O2S
Molecular Weight:
224.2795
MDL Number:
MFCD23952533
IUPAC Name:
6-(1-oxo-1,4-thiazinan-4-yl)pyridine-3-carbaldehyde
InChI:
InChI=1S/C10H12N2O2S/c13-8-9-1-2-10(11-7-9)12-3-5-15(14)6-4-12/h1-2,7-8H,3-6H2
InChI Key:
XIZOXIYKLPGFBY-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(nc1)N1CCS(=O)CC1
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.062g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.278g/mol
Monoisotopic Mass:
224.062g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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