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ALLOXYDIM-SODIUM

CAS No.:
55635-13-7
Catalog Number:
AG00DESF
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00DESF
Chemical Name:
ALLOXYDIM-SODIUM
CAS Number:
55635-13-7
MDL Number:
MFCD16657007
IUPAC Name:
sodium;4-methoxycarbonyl-5,5-dimethyl-3-oxo-2-[(E)-N-prop-2-enoxy-C-propylcarbonimidoyl]cyclohexen-1-olate
InChI:
InChI=1S/C17H25NO5.Na/c1-6-8-11(18-23-9-7-2)13-12(19)10-17(3,4)14(15(13)20)16(21)22-5;/h7,14,19H,2,6,8-10H2,1,3-5H3;/q;+1/p-1/b18-11+;
InChI Key:
SZXAJDQTPWYNBN-NWBUNABESA-M
Properties
Complexity:
551  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
345.155g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
345.371g/mol
Monoisotopic Mass:
345.155g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
88A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties