CAS RN 29412-85-9
CAS RN 29412-85-9
IUPAC Name:
2-({[3-(3-{[bis(carboxymethyl)amino]methyl}-4-hydroxy-2,5-dimethylphenyl)-2,2-dioxo-3H-1,2λ⁶-benzoxathiol-3-yl]methyl}(carboxymethyl)amino)acetic acid hydrate sodium
Synonyms:
({[3-(3-{[bis(carboxymethyl)amino]methyl}-4-hydroxy-2,5-dimethylphenyl)-2,2-dioxo-1,2λ⁶-benzoxathiol-3-yl]methyl}(carboxymethyl)amino)acetic acid hydrate sodium
Molecular Weight (g/mol):
621.57
Molecular Formula:
C25H30N2NaO13S
InChi Key:
NHDTXEGRWRPXMN-UHFFFAOYNA-N
SMILES:
O.[Na].CC1=C(O)C(CN(CC(O)=O)CC(O)=O)=C(C)C(=C1)C1(CN(CC(O)=O)CC(O)=O)C2=CC=CC=C2OS1(=O)=O
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Methylxylenol Blue 85.0+%, TCI America™

CAS: 29412-85-9 Molecular Formula: C25H29N2NaO13S Molecular Weight (g/mol): 620.558 MDL Number: MFCD00065250 InChI Key: VYPGOJHOWVUMIQ-UHFFFAOYSA-M PubChem CID: 131674796 IUPAC Name: sodium;2-[[5-[3-[[bis(carboxymethyl)amino]methyl]-2,2-dioxo-1,2$l^{6}-benzoxathiol-3-yl]-2-hydroxy-3,6-dimethylphenyl]methyl-(carboxymethyl)amino]acetate;hydrate SMILES: CC1=C(C(=C(C(=C1)C2(C3=CC=CC=C3OS2(=O)=O)CN(CC(=O)O)CC(=O)O)C)CN(CC(=O)O)CC(=O)[O-])O.O.[Na+]