Home Sulfos Benzenesulfonic acid,4,4',4'',4'''-(21H,23H-porphine-5,10,15,20-tetrayl)tetrakis-, ion(4-)

Benzenesulfonic acid,4,4',4'',4'''-(21H,23H-porphine-5,10,15,20-tetrayl)tetrakis-, ion(4-)

CAS No.:
39174-47-5
Catalog Number:
AG00C8MA
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C8MA
Chemical Name:
Benzenesulfonic acid,4,4',4'',4'''-(21H,23H-porphine-5,10,15,20-tetrayl)tetrakis-, ion(4-)
CAS Number:
39174-47-5
MDL Number:
MFCD00064854
IUPAC Name:
tetrasodium;4-[10,15,20-tris(4-sulfonatophenyl)-21,23-dihydroporphyrin-5-yl]benzenesulfonate;dodecahydrate
InChI:
InChI=1S/C44H30N4O12S4.4Na.12H2O/c49-61(50,51)29-9-1-25(2-10-29)41-33-17-19-35(45-33)42(26-3-11-30(12-4-26)62(52,53)54)37-21-23-39(47-37)44(28-7-15-32(16-8-28)64(58,59)60)40-24-22-38(48-40)43(36-20-18-34(41)46-36)27-5-13-31(14-6-27)63(55,56)57;;;;;;;;;;;;;;;;/h1-24,45,48H,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60);;;;;12*1H2/q;4*+1;;;;;;;;;;;;/p-4
InChI Key:
STYHVYFZXMZUMU-UHFFFAOYSA-J
EC Number:
254-262-8
Properties
Complexity:
1720  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
17  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
1238.129g/mol
Formal Charge:
0
Heavy Atom Count:
80  
Hydrogen Bond Acceptor Count:
26  
Hydrogen Bond Donor Count:
14  
Isotope Atom Count:
0
Molecular Weight:
1239.087g/mol
Monoisotopic Mass:
1238.129g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
332A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties