GRN4VRE6GK structure

GRN4VRE6GK

2-[bis(2-hydroxyethyl)amino]ethanol;6-methyl-2-[4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]-1,3-benzothiazole-7-sulfonic acid

Also Known As: 2-(4-((Hexahydro-2,4,6-trioxo-5-pyrimidyl)azo)phenyl)-6-methylbenzothiazole-7-sulphonic acid, compound with 2,2',2''-nitrilotris(ethanol) (1:1)|6-methyl-2-{4-[(e)-(2,4,6-trioxohexahydropyrimidin-5-yl)diazenyl]phenyl}-1,3-benzothiazole-7-sulfonic acid- 2,2',2''-nitrilotriethanol(1:1)|7-Benzothiazolesulfonic acid, 2-[4-[(hexahydro-2,4,6-trioxo-5-pyrimidinyl)azo]phenyl]-6-methyl-, compd. with 2,2',2''-nitrilotris[ethanol] (1:1)|2-(4-((Hexahydro-2,4,6-trioxo-5-pyrimidyl)azo)phenyl)-6-methylbenzothiazole-7-sulphonic acid, compound with 2,2',2''-nitrilotris(ethanol)|2-(4-((Hexahydro-2,4,6-trioxo-5-pyrimidyl)azo)phenyl)-6-methylbenzothiazole-7-sulphonic acid, compound with 2,2,2-nitrilotris(ethanol) (1:1)|2-[4-[(hexahydro-2,4,6-trioxo-5-pyrimidyl)azo]phenyl]-6-methylbenzothiazole-7-sulphonic acid, compound with 2,2',2''-nitrilotris[ethanol] (1:1)|2-[bis(2-hydroxyethyl)amino]ethanol; 6-methyl-2-[4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]-1,3-benzothiazole-7-sulfonic acid|265-314-4|6-Methyl-2-{4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl}-1,3-benzothiazole-7-sulfonic acid--2,2',2''-nitrilotri(ethan-1-ol) (1/1)|7-Benzothiazolesulfonic acid, 2-(4-((hexahydro-2,4,6-trioxo-5-pyrimidinyl)azo)phenyl)-6-methyl-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)|7-Benzothiazolesulfonic acid, 2-(4-(2-(hexahydro-2,4,6-trioxo-5-pyrimidinyl)diazenyl)phenyl)-6-methyl-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)|7-Benzothiazolesulfonic acid, 2-(p-((hexahydro-2,4,6-trioxo-5-pyrimidinyl)azo)phenyl)-6-methyl-, triethanolamine salt (1:1)|7-Benzothiazolesulfonic acid, 2-[4-[2-(hexahydro-2,4,6-trioxo-5-pyrimidinyl)diazenyl]phenyl]-6-methyl-, compd. with 2,2',2''-nitrilotris[ethanol]|7-Benzothiazolesulfonic acid, 2-[4-[2-(hexahydro-2,4,6-trioxo-5-pyrimidinyl)diazenyl]phenyl]-6-methyl-, compd. with 2,2',2''-nitrilotris[ethanol] (1:1)

CAS: 7331-22-8
Molecular Formula C24H28N6O9S2
Molecular Weight 608.1359 g/mol
LogP 0.60202
Topological Polar Surface Area 268.0 Ų
Hydrogen Bond Donors 6
Hydrogen Bond Acceptors 14
Rotatable Bonds 10
Exact Mass 608.1359
Monoisotopic Mass 608.1359
Heavy Atoms 41
Complexity 918.0

Chemical Identifiers

CAS Number 7331-22-8
SMILES CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N=NC4C(=O)NC(=O)NC4=O)S(=O)(=O)O.C(CO)N(CCO)CCO
InChIKey AZHSURPXVDEIHG-UHFFFAOYSA-N

Product Overview

GRN4VRE6GK (CAS 7331-22-8), with molecular formula C24H28N6O9S2 and molecular weight 608.1359 g/mol. IUPAC: 2-[bis(2-hydroxyethyl)amino]ethanol;6-methyl-2-[4-[(2,4,6-trioxo-1,3-diazinan-5-yl)diazenyl]phenyl]-1,3-benzothiazole-7-sulfonic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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