Home Carboxys methyl 8-amino-5,5-dioxo-5lambda6-thiaspiro[3.5]nonane-2-carboxylate hydrochloride

methyl 8-amino-5,5-dioxo-5lambda6-thiaspiro[3.5]nonane-2-carboxylate hydrochloride

CAS No.:
2138004-47-2
Catalog Number:
AG01EJKR
Molecular Formula:
C10H18ClNO4S
Molecular Weight:
283.7722
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Product Description
Catalog Number:
AG01EJKR
Chemical Name:
methyl 8-amino-5,5-dioxo-5lambda6-thiaspiro[3.5]nonane-2-carboxylate hydrochloride
CAS Number:
2138004-47-2
Molecular Formula:
C10H18ClNO4S
Molecular Weight:
283.7722
MDL Number:
MFCD31457221
IUPAC Name:
methyl 8-amino-5,5-dioxo-5λ6-thiaspiro[3.5]nonane-2-carboxylate;hydrochloride
InChI:
InChI=1S/C10H17NO4S.ClH/c1-15-9(12)7-4-10(5-7)6-8(11)2-3-16(10,13)14;/h7-8H,2-6,11H2,1H3;1H
InChI Key:
KNMNKGDYSUTVCU-UHFFFAOYSA-N
SMILES:
COC(=O)C1CC2(C1)CC(N)CCS2(=O)=O.Cl
Properties
Complexity:
392  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.065g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
283.767g/mol
Monoisotopic Mass:
283.065g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
94.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties