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NITR 5 TETRASODIUM SALT* - CAS 208709-26-6

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Category
Main Product
Product Name
NITR 5 TETRASODIUM SALT*
Catalog Number
208709-26-6
Synonyms
tetrasodium;2-[2-[2-[2-[bis(carboxylatomethyl)amino]-5-[hydroxy-(6-nitro-1,3-benzodioxol-5-yl)methyl]phenoxy]ethoxy]-N-(carboxylatomethyl)-4-methylanilino]acetate;NITR5TETRASODIUMSALT*;Nitr5tetrasodiumsalt;208709-26-6;72540_FLUKA
CAS Number
208709-26-6
Molecular Weight
773.52
Molecular Formula
C31H27N3O15.4Na
COA
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MSDS
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Canonical SMILES
CC1=CC(=C(C=C1)N(CC(=O)[O-])CC(=O)[O-])OCCOC2=C(C=CC(=C2)C(C3=CC4=C(C=C3[N+](=O)[O-])OCO4)O)N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+]
InChI
InChI=1S/C31H31N3O15.4Na/c1-17-2-4-20(32(12-27(35)36)13-28(37)38)23(8-17)46-6-7-47-24-9-18(3-5-21(24)33(14-29(39)40)15-30(41)42)31(43)19-10-25-26(49-16-48-25)11-22(19)34(44)45;;;;/h2-5,8-11,31,43H,6-7,12-16H2,1H3,(H,35,36)(H,37,38)(H,39,40)(H,41,42);;;;/q;4*+1/p-4
InChIKey
UYFVGVJTEBNQDY-UHFFFAOYSA-J
Structure
CAS 208709-26-6 NITR 5 TETRASODIUM SALT*
Specification
Purity
95%
Storage
-20ºC
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