200,000+ products from a single source!
sales@angenechem.com
73398-52-4 | 2,7-Naphthalenedisulfonicacid, 4-hydroxy-5-[[4-[[5-hydroxy-6-[2-(4-methoxy-2-sulfophenyl)diazenyl]-7-sulfo-2-naphthalenyl]amino]-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-3-(2-phenyldiazenyl)-,sodium salt (1:4)
CAS No: 73398-52-4 Catalog No: AG005EE7 MDL No:
Product Description
Catalog Number:
AG005EE7
Chemical Name:
2,7-Naphthalenedisulfonicacid, 4-hydroxy-5-[[4-[[5-hydroxy-6-[2-(4-methoxy-2-sulfophenyl)diazenyl]-7-sulfo-2-naphthalenyl]amino]-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-3-(2-phenyldiazenyl)-,sodium salt (1:4)
CAS Number:
73398-52-4
Molecular Formula:
C40H30N10Na4O16S4
Molecular Weight:
1126.9427
IUPAC Name:
tetrasodium;4-hydroxy-5-[[4-[[5-hydroxy-6-[(4-methoxy-2-sulfonatophenyl)diazenyl]-7-sulfonatonaphthalen-2-yl]amino]-6-morpholin-4-yl-1,3,5-triazin-2-yl]amino]-3-phenyldiazenylnaphthalene-2,7-disulfonate
InChI:
InChI=1S/C40H34N10O16S4.4Na/c1-65-25-8-10-28(30(19-25)68(56,57)58)47-49-34-31(69(59,60)61)17-21-15-24(7-9-27(21)36(34)51)41-38-43-39(45-40(44-38)50-11-13-66-14-12-50)42-29-20-26(67(53,54)55)16-22-18-32(70(62,63)64)35(37(52)33(22)29)48-46-23-5-3-2-4-6-23;;;;/h2-10,15-20,51-52H,11-14H2,1H3,(H,53,54,55)(H,56,57,58)(H,59,60,61)(H,62,63,64)(H2,41,42,43,44,45);;;;/q;4*+1/p-4
InChI Key:
SJNJGMHBWNSMCF-UHFFFAOYSA-J
SMILES:
COc1ccc(c(c1)S(=O)(=O)[O-])N=Nc1c(O)c2ccc(cc2cc1S(=O)(=O)[O-])Nc1nc(nc(n1)N1CCOCC1)Nc1cc(cc2c1c(O)c(c(c2)S(=O)(=O)[O-])N=Nc1ccccc1)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]
EC Number:
277-450-1
Properties
Complexity:
2240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
5
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
1126.031g/mol
Formal Charge:
0
Heavy Atom Count:
74
Hydrogen Bond Acceptor Count:
26
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
1126.933g/mol
Monoisotopic Mass:
1126.031g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
437A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.