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Home > Aldehydes > 914348-62-2
914348-62-2 | 4-Chloro-2-(4-oxopiperidin-1-yl);thiazole-5-carbaldehyde
CAS No: 914348-62-2 Catalog No: AG006AQS MDL No:MFCD03453086
Product Description
Catalog Number:
AG006AQS
Chemical Name:
4-Chloro-2-(4-oxopiperidin-1-yl);thiazole-5-carbaldehyde
CAS Number:
914348-62-2
Molecular Formula:
C9H9ClN2O2S
Molecular Weight:
244.6980
MDL Number:
MFCD03453086
IUPAC Name:
4-chloro-2-(4-oxopiperidin-1-yl)-1,3-thiazole-5-carbaldehyde
InChI:
InChI=1S/C9H9ClN2O2S/c10-8-7(5-13)15-9(11-8)12-3-1-6(14)2-4-12/h5H,1-4H2
InChI Key:
OYKDHYMMKKENHN-UHFFFAOYSA-N
SMILES:
O=Cc1sc(nc1Cl)N1CCC(=O)CC1
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.007g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.693g/mol
Monoisotopic Mass:
244.007g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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