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1,4-Butanedisulfonic acid, 1,4-dihydroxy-, sodium salt (1:2)

HCID 21592
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Basic information

CAS
5450-96-4
Standard SMILES
O=S(=O)([O-])C(O)CCC(O)S(=O)(=O)[O-].[Na+].[Na+]
InChIKey
SSGMHPVCXKEOSW-UHFFFAOYSA-L
Molecular formula
C4H8Na2O8S2
Average molar mass
294.2 g/mol
Monoisotopic mass
293.94559812

Names & identifiers

Preferred name
1,4-Butanedisulfonic acid, 1,4-dihydroxy-, sodium salt (1:2)
IUPAC
disodium;1,4-dihydroxybutane-1,4-disulfonate
English name
SUCCINALDEHYDE SODIUM BISULFITE
Molecular formula
C4H8Na2O8S2
Molecular weight
294.21

Names & synonyms

Succinaldehyde disodium bisulfite1,4-BUTANEDISULFONIC ACID, 1,4-DIHYDROXY-, DISODIUM SALTSuccinaldehyde sodium bisulfiteEINECS 226-676-9Disodium 1,4-dihydroxy-1,4-butanedisulfonateNSC 18260Succinaldehyde, bis(sodium bisulfite)Succinaldehyde, sulfite (1:2), disodium salt1,4-Butenedisulfonic acid, 1,4-dihydroxy-, disodium saltSuccinaldehyde-sodium bisulfite compound (1:2)1,4-Butanedisulfonic acid, 1,4-dihydroxy-, sodium salt (1:2)RefChem:416554
Show more names
Succinaldehyde soSUCCINALDEHYDE SODIUM BISULFITE 92%Succinaldehyde bis-(sodium bisulfite)Succinaldehyde disodium bisulfite,92%Succinaldehyde Disodium Bisulfite >Butanedial·sodium bisulfite(1:2) addactSuccinaldehyde sodium bisulfite(1:2) addact
5450-96-4disodium 1,4-dihydroxybutane-1,4-disulfonatedisodium;1,4-dihydroxybutane-1,4-disulfonateMFCD00024982Sodium succinaldehyde bisulfite1,4-Dihydroxy-1,4-butanedisulfonic acid disodium saltSODIUM 1,4-DIHYDROXYBUTANE-1,4-DISULFONATEDisodium 1,4-dihydroxybutane-1,4-disulphonate

Database identifiers

CAS
5450-96-4
PubChem CID
21592
DTXSID
DTXSID70889485
EC Number
226-676-9
Nikkaji
J42.097B

Properties

Computed structural properties

Topological polar surface area
172 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
3
Heavy atoms
16
Formal charge
0
Complexity
290

Physicochemical properties

Melting point
300 °C · 300 °C
storage temp.
Refrigerator
Water Solubility
Soluble in water
form
solid
color
White
InChI
InChI=1S/C4H10O8S2.2Na/c5-3(13(7,8)9)1-2-4(6)14(10,11)12;;/h3-6H,1-2H2,(H,7,8,9)(H,10,11,12);;/q;2*+1/p-2
InChIKey
SSGMHPVCXKEOSW-UHFFFAOYSA-L
SMILES
S([O-])(=O)(=O)C(O)CCC(O)S([O-])(=O)=O.[Na+].[Na+]
EPA Substance Registry System
1 · Disodium 1,4-dihydroxy-1,4-butanedisulfonate (5450-96-4)
Safety Statements
24 · 24/25
RTECS
3585000 · EK3585000
TSCA
TSCA listed
HS Code
2913 · 2913.00.5000

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 InformationChemical: 1,4-Butanedisulfonic acid, 1,4-dihydroxy-, disodium salt

Safety data

tsca
TSCA listed
rtecs
EK3585000
hs_code
2913.00.5000
safety_code
24/25

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1,4-Butanedisulfonic acid, 1,4-dihydroxy-, sodium salt (1:2): ACTIVE

Related reactions

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Compound notes

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