Home Carbonyls 4-(oxane-4-carbonyl)thiomorpholine

4-(oxane-4-carbonyl)thiomorpholine

CAS No.:
1258732-00-1
Catalog Number:
AG01C4P2
Molecular Formula:
C10H17NO2S
Molecular Weight:
215.3125
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Product Description
Catalog Number:
AG01C4P2
Chemical Name:
4-(oxane-4-carbonyl)thiomorpholine
CAS Number:
1258732-00-1
Molecular Formula:
C10H17NO2S
Molecular Weight:
215.3125
MDL Number:
MFCD29906955
IUPAC Name:
oxan-4-yl(thiomorpholin-4-yl)methanone
InChI:
InChI=1S/C10H17NO2S/c12-10(9-1-5-13-6-2-9)11-3-7-14-8-4-11/h9H,1-8H2
InChI Key:
TXTCRBUQORWZGT-UHFFFAOYSA-N
SMILES:
O=C(N1CCSCC1)C1CCOCC1
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.098g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.311g/mol
Monoisotopic Mass:
215.098g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties