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1042646-34-3

1042646-34-3 | 1-(1,3-thiazol-4-ylmethyl)piperidin-4-one

CAS No: 1042646-34-3 Catalog No: AG019X71 MDL No:MFCD11171164

Product Description

Catalog Number:
AG019X71
Chemical Name:
1-(1,3-thiazol-4-ylmethyl)piperidin-4-one
CAS Number:
1042646-34-3
Molecular Formula:
C9H12N2OS
Molecular Weight:
196.2694
MDL Number:
MFCD11171164
IUPAC Name:
1-(1,3-thiazol-4-ylmethyl)piperidin-4-one
InChI:
InChI=1S/C9H12N2OS/c12-9-1-3-11(4-2-9)5-8-6-13-7-10-8/h6-7H,1-5H2
InChI Key:
RIXYMHMADJTMEB-UHFFFAOYSA-N
SMILES:
O=C1CCN(CC1)Cc1ncsc1

Properties

Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.067g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.268g/mol
Monoisotopic Mass:
196.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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