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glycine, n,n-bis(2-hydroxy-5-sulfophenyl)methyl-, trisodium salt

HCID 170649
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Basic information

CAS
42419-94-3
Standard SMILES
O=C([O-])CN(Cc1cc(S(=O)(=O)[O-])ccc1O)Cc1cc(S(=O)(=O)[O-])ccc1O.[Na+].[Na+].[Na+]
InChIKey
ZYOINXVOXQFEIP-UHFFFAOYSA-K
Molecular formula
C16H14NNa3O10S2
Average molar mass
513.4 g/mol
Monoisotopic mass
512.97522084

Names & identifiers

Preferred name
glycine, n,n-bis(2-hydroxy-5-sulfophenyl)methyl-, trisodium salt
IUPAC
trisodium;2-[bis[(2-hydroxy-5-sulfonatophenyl)methyl]amino]acetate
English name
Glycine, N,N-bis(2-hydroxy-5-sulfophenyl)methyl-, trisodium salt
Molecular formula
C16H18NNaO10S2
Molecular weight
471.43

Names & synonyms

Glycine, N,N-bis[(2-hydroxy-5-sulfophenyl)methyl]-, trisodium saltDTXSID2068393Glycine, N,N-bis((2-hydroxy-5-sulfophenyl)methyl)-, trisodium saltglycine, n,n-bis(2-hydroxy-5-sulfophenyl)methyl-, trisodium saltRefChem:346301DTXCID604011142419-94-3trisodium;2-[bis[(2-hydroxy-5-sulfonatophenyl)methyl]amino]acetateN,N-Bis(2-hydroxy-5-sulfobenzyl)glycine, trisodium saltGlycine, N,N-bis((2-hydroxy-5-sulfophenyl)methyl)-, sodium salt (1:3)Trisodium {bis[(2-hydroxy-5-sulfonatophenyl)methyl]amino}acetateHamplex DPS
Show more names
Glycinen N-bis[(2-hydroxy-5-sulfophenyl)methyl]-trisodiumGlycinen N-bis[(2-hydroxy-5-sulfophenyl)methyl]- trisodiumn,n-bis[(2-hydroxy-5-sulfophenyl)methyl]-glycintrisodium saltN,N-Bis[(2-hydroxy-5-sulfophenyl)methyl]glycine trisodium saltn,n-bis[(2-hydroxy-5-sulfophenyl)methyl]-glycin trisodium salt

Properties

Computed structural properties

Topological polar surface area
215 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
11
Rotatable bonds
5
Heavy atoms
32
Formal charge
0
Complexity
682

Physicochemical properties

EPA Substance Registry System
Glycine, N,N-bis[(2-hydroxy-5-sulfophenyl)methyl]-, trisodium salt (42419-94-3)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Regulatory Information · 2 items

Chemical: Glycine, N,N-bis[(2-hydroxy-5-sulfophenyl)methyl]-, trisodium salt

Glycine, N,N-bis(2-hydroxy-5-sulfophenyl)methyl-, trisodium salt: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationGlycine, N,N-bis[(2-hydroxy-5-sulfophenyl)methyl]-, sodium salt (1:3): INACTIVE

Related reactions

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Compound notes

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Database identifiers

CAS
42419-94-3
PubChem CID
170649
DTXSID
DTXSID2068393