AG00ICRC

76656-36-5 | Benzenesulfonic acid, 3,3'-carbonylbis[4-hydroxy-6-methoxy-, disodiumsalt

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CAS Number	76656-36-5
Catalog Number	AG00ICRC(AGN-PC-0UA9J2)
Chemical Name	Benzenesulfonic acid, 3,3'-carbonylbis[4-hydroxy-6-methoxy-, disodiumsalt
EC Number	278-520-4
IUPAC Name	disodium;4-hydroxy-5-(2-hydroxy-4-methoxy-5-sulfonatobenzoyl)-2-methoxybenzenesulfonate
InChI	InChI=1S/C15H14O11S2.2Na/c1-25-11-5-9(16)7(3-13(11)27(19,20)21)15(18)8-4-14(28(22,23)24)12(26-2)6-10(8)17;;/h3-6,16-17H,1-2H3,(H,19,20,21)(H,22,23,24);;/q;2*+1/p-2
InChI Key	QDCHWIWENYCPIL-UHFFFAOYSA-L
MDL Number	MFCD02683831
Molecular Formula	C15H12Na2O11S2
Molecular Weight	478.3587
SMILES	O=S(C1=CC=C(C(C2=CC(S(=O)([O-])=O)=C(OC)C=C2O)=O)C(O)=C1OC)([O-])=O.[Na+].[Na+]
UNII	7925W14T4L
Synonyms	Benzophenone-9, 76656-36-5, UNII-7925W14T4L, Disodium 2,2'-dihydroxy-4,4'-dimethoxy-5,5'-disulfobenzophenone, 2,2'-Dihydroxy-4,4'-dimethoxybenzophenone-5,5'-disulfonic acid disodium salt, 7925W14T4L, 2,2'-Dihydroxy-4,4'-dimethoxy-5,5'-disulfobenzophenone, disodium salt, Uvinuc ds 49, W-104351, Benzophenone 9, 2,2'-Dihydroxy-4,4'-dimethoxybenzophenone-5,5'-disulphonic acid sodium salt, Uvinul 3048, benzophenone9, disodium 4-hydroxy-5-(2-hydroxy-4-methoxy-5-sulfonatobenzoyl)-2-methoxybenzenesulfonate, EINECS 278-520-4, 2,2'-DIHYDROXY-4,4'-DIMETHOXY BENZOPHENONE-5,5'-DISODIUM SULFONATE, AC1Q1UYU, AC1L4D9U, SCHEMBL240880, C15H12Na2O11S2, CTK8J7319, QDCHWIWENYCPIL-UHFFFAOYSA-L, Benzophenone-9, analytical standard, ZX-AT029394, KM1786, MFCD02683831, AKOS015889564, Benzenesulfonic acid, 3,3'-carbonylbis(4-hydroxy-6-methoxy-, disodium salt, OR11367, RL04921, Benzenesulfonic acid, 3,3'-carbonylbis(4-hydroxy-6-methoxy-, sodium salt (1:2), AN-36902, AS-16084, S292, FT-0622723, I01-19823, sodium 5,5'-carbonylbis(4-hydroxy-2-methoxybenzenesulfonate), Disodium 3,3'-carbonylbis(4-hydroxy-6-methoxybenzenesulphonate), Benzenesulfonic acid, 3,3'-carbonylbis[4-hydroxy-6-methoxy-, disodiumsalt, DISODIUM 3,3'-CARBONYLBIS(4-HYDROXY-6-METHOXYBENZENESULFONATE), 2,2'-Dihydroxy-4,4'-dimethoxybenzophenone-5,5'-disulfonic acid disodium sal t, dipotassium 4-hydroxy-5-(2-hydroxy-4-methoxy-5-sulfonatobenzoyl)-2-methoxybenzenesulfonate, disodium 4-hydroxy-5-(2-hydroxy-4-methoxy-5-sulfonato-benzoyl)-2-methoxy-benzenesulfonate, disodium,4-hydroxy-5-(2-hydroxy-4-methoxy-5-sulfonatobenzoyl)-2-methoxybenzenesulfonate, C15H14O11S2.2Na, CID154926, C15-H14-O11-S2.2Na, Benzenesulfonic acid, 3,3'-carbonylbis[4-hydroxy-6-methoxy-, disodium salt, Disodium 3,3'-carbonylbis[4-hydroxy-6-methoxybenzenesulphonate], Benzenesulfonic acid, 3,3'-carbonylbis[4-hydroxy-6-methoxy-, sodium salt (1:2),

Complexity	676
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	477.962g/mol
Formal Charge	0
Heavy Atom Count	30
Hydrogen Bond Acceptor Count	11
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	478.35g/mol
Monoisotopic Mass	477.962g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	207A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number