200,000+ products from a single source!
sales@angenechem.com
68612-74-8 | bis[5-[3-(5-cyano-1-hexyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridyl)allylidene]-1-hexyl-1,2,5,6-tetrahydro-4-methyl-2,6-dioxonicotinonitrile], calcium salt
CAS No: 68612-74-8 Catalog No: AG00FKRP MDL No:
Product Description
Catalog Number:
AG00FKRP
Chemical Name:
bis[5-[3-(5-cyano-1-hexyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridyl)allylidene]-1-hexyl-1,2,5,6-tetrahydro-4-methyl-2,6-dioxonicotinonitrile], calcium salt
CAS Number:
68612-74-8
IUPAC Name:
calcium;5-cyano-3-[(E,3Z)-3-(5-cyano-1-hexyl-4-methyl-2,6-dioxopyridin-3-ylidene)prop-1-enyl]-1-hexyl-4-methyl-6-oxopyridin-2-olate
InChI:
InChI=1S/2C29H36N4O4.Ca/c2*1-5-7-9-11-16-32-26(34)22(20(3)24(18-30)28(32)36)14-13-15-23-21(4)25(19-31)29(37)33(27(23)35)17-12-10-8-6-2;/h2*13-15,34H,5-12,16-17H2,1-4H3;/q;;+2/p-2/b2*14-13+,23-15-;
InChI Key:
CUZBLTZSQULSDI-ZWTDXGKKSA-L
EC Number:
271-908-4
Properties
Complexity:
1110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
4
Exact Mass:
1046.494g/mol
Formal Charge:
0
Heavy Atom Count:
75
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
1047.324g/mol
Monoisotopic Mass:
1046.494g/mol
Rotatable Bond Count:
24
Topological Polar Surface Area:
257A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.