Basic information
- CAS
853-68-9- Standard SMILES
O=C1c2ccc(S(=O)(=O)[O-])cc2C(=O)c2ccc(S(=O)(=O)[O-])cc21.[Na+].[Na+]- InChIKey
PKOVWEHDVFYKHL-UHFFFAOYSA-L- Molecular formula
- C14H6Na2O8S2
- Average molar mass
- 412.3 g/mol
- Monoisotopic mass
- 411.92994806
Names & identifiers
- Preferred name
- Sodium anthraquinone-2,6-disulfonate
- IUPAC
- disodium;9,10-dioxoanthracene-2,6-disulfonate
- English name
- Anthraquinone-2,6-disulfonic acid disodium salt
- Molecular formula
- C14H9NaO8S2
- Molecular weight
- 392.33
Names & synonyms
Anthraquinone-2,6-disulfonic acid disodium saltDisodium anthraquinone-2,6-disulfonateNSC 4997EINECS 212-719-9Sodium anthraquinone-2,6-disulfonate9,10-Anthraquinone-2,6-disulfonic acid disodium saltDisodium 9,10-anthraquinone-2,6-disulfonateDisodium 9,10-dihydro-9,10-dioxoanthracene-2,6-disulphonate2,6-Anthracenedisulfonic acid, 9,10-dihydro-9,10-dioxo-, sodium salt (1:2)RefChem:887264Disodium anthraquinone2,6disulfonateDisodium 9,10anthraquinone2,6disulfonate
Show more names
GCNANTHRAQUINONE-2Quinone dimethylbutyrate ≥98%ANTHRAQUINONE-2,6-DSA DISODIUM6-disulfonic acid disodiuM saltSodiumanthraquinone-2,6-disulfonateANTHRAQUINONE-2,6-DISULFONIC ACID-2NAsodiumanthraquinone-2,6(2,7)-disulfonate9 10-ANTHRAQUINONE-2 6-DISULFONIC ACID &
Anthraquinone2,6disulfonic acid disodium salt9,10Anthraquinone2,6disulfonic acid disodium saltDisodium 9,10dihydro9,10dioxoanthracene2,6disulphonate2,6Anthracenedisulfonic acid, 9,10dihydro9,10dioxo, disodium salt2,6Anthracenedisulfonic acid, 9,10dihydro9,10dioxo, sodium salt (1:2)212-719-9853-68-9Sodium 9,10-dioxo-9,10-dihydroanthracene-2,6-disulfonate
Properties
Computed structural properties
- Topological polar surface area
- 165 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 0
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 665
Experimental & physicochemical properties
Chemical ClassesDyes -> Anthraquinone Dyes
Physical DescriptionSolid; [Sigma-Aldrich MSDS]
Physicochemical properties
- Melting point
- 325 °C · 325 °C
- storage temp.
- Hygroscopic, Refrigerator, under inert atmosphere
- solubility
- 2 O: · H2O: 10 mg/mL, clear
- form
- Solid
- color
- White to Pale Yellow
- Stability
- Stable. Incompatible with strong oxidizing agents.
- InChI
- InChI=1S/C14H8O8S2.Na.H/c15-13-9-3-1-7(23(17,18)19)5-11(9)14(16)10-4-2-8(6-12(10)13)24(20,21)22;;/h1-6H,(H,17,18,19)(H,20,21,22);;
- InChIKey
- HYIFCKFCRGCAGY-UHFFFAOYSA-N
- SMILES
- O=C1C2=CC=C(S(O)(=O)=O)C=C2C(=O)C2C=CC(S(O)(=O)=O)=CC1=2.[NaH]
- CAS DataBase Reference
- 853 · 853-68-9(CAS DataBase Reference)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (95.2%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 42 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationREACH registered substance: Disodium 9,10-dihydro-9,10-dioxoanthracene-2,6-disulphonate (EC: 212-719-9)
Hazards SummaryA skin and strong eye irritant; [Sigma-Aldrich MSDS] See Sodium alizarinesulfonate, Alizarin Red S, and Sodium alizarinesulfonate.
Hazard Classes and CategoriesSkin Irrit. 2 (95.2%)
Safety data
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29147000
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36-37/39
- Hazard statements
- H315-H319-H335
- REACH Registrations
- Active
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2,6-Anthracenedisulfonic acid, 9,10-dihydro-9,10-dioxo-, sodium salt (1:2): ACTIVE
Applications
UsesDisodium anthraquinone-2,6-disulfonate is an anthraquinone compound for proteomics research.
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
南通润丰石油化工有限公司66017690 19952660367 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
陕西鼎创美捷化工有限公司15209235325; 15209235325 · [email protected]
上海瀚麟生物科技有限公司183-0212-4410 18302124410 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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