Home Carboxys 1,1-dioxo-1lambda6-thiomorpholine-3-carboxylic acid hydrochloride

1,1-dioxo-1lambda6-thiomorpholine-3-carboxylic acid hydrochloride

CAS No.:
1461706-29-5
Catalog Number:
AG01AC2K
Molecular Formula:
C5H10ClNO4S
Molecular Weight:
215.6552
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Product Description
Catalog Number:
AG01AC2K
Chemical Name:
1,1-dioxo-1lambda6-thiomorpholine-3-carboxylic acid hydrochloride
CAS Number:
1461706-29-5
Molecular Formula:
C5H10ClNO4S
Molecular Weight:
215.6552
MDL Number:
MFCD26407840
IUPAC Name:
1,1-dioxo-1,4-thiazinane-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C5H9NO4S.ClH/c7-5(8)4-3-11(9,10)2-1-6-4;/h4,6H,1-3H2,(H,7,8);1H
InChI Key:
NJFKFCKXKGINON-UHFFFAOYSA-N
SMILES:
OC(=O)C1NCCS(=O)(=O)C1.Cl
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.002g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
215.648g/mol
Monoisotopic Mass:
215.002g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties