Home Other Building Blocks 3-(5-methylfuran-2-yl)-1lambda6-thiomorpholine-1,1-dione

3-(5-methylfuran-2-yl)-1lambda6-thiomorpholine-1,1-dione

CAS No.:
1315367-75-9
Catalog Number:
AG01AJJW
Molecular Formula:
C9H13NO3S
Molecular Weight:
215.2694
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Product Description
Catalog Number:
AG01AJJW
Chemical Name:
3-(5-methylfuran-2-yl)-1lambda6-thiomorpholine-1,1-dione
CAS Number:
1315367-75-9
Molecular Formula:
C9H13NO3S
Molecular Weight:
215.2694
MDL Number:
MFCD19382325
IUPAC Name:
3-(5-methylfuran-2-yl)-1,4-thiazinane 1,1-dioxide
InChI:
InChI=1S/C9H13NO3S/c1-7-2-3-9(13-7)8-6-14(11,12)5-4-10-8/h2-3,8,10H,4-6H2,1H3
InChI Key:
REJZURMMYILMLT-UHFFFAOYSA-N
SMILES:
Cc1ccc(o1)C1NCCS(=O)(=O)C1
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.062g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.267g/mol
Monoisotopic Mass:
215.062g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties