1-Naphthol-3,6-disulfonic acid disodium salt hydrate - CAS 330581-20-9
Catalog: |
BB021535 |
Product Name: |
1-Naphthol-3,6-disulfonic acid disodium salt hydrate |
CAS: |
330581-20-9 |
Synonyms: |
disodium;4-hydroxynaphthalene-2,7-disulfonate;hydrate |
IUPAC Name: | disodium;4-hydroxynaphthalene-2,7-disulfonate;hydrate |
Description: | 1-Naphthol-3,6-disulfonic acid disodium salt hydrate (CAS# 330581-20-9 ) is a useful research chemical. |
Molecular Weight: | 348.26 (anhydrous basis) |
Molecular Formula: | C10H8Na2O8S2 |
Canonical SMILES: | C1=CC2=C(C=C(C=C2C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])O.O.[Na+].[Na+] |
InChI: | InChI=1S/C10H8O7S2.2Na.H2O/c11-10-5-8(19(15,16)17)4-6-3-7(18(12,13)14)1-2-9(6)10;;;/h1-5,11H,(H,12,13,14)(H,15,16,17);;;1H2/q;2*+1;/p-2 |
InChI Key: | BJNIHPYLVMUUPO-UHFFFAOYSA-L |
Appearance: | Light brown powder |
MDL: | MFCD00149250 |
LogP: | 2.45090 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
KR-20200064916-A | Novel compound and organic light emitting device comprising the same | 20181129 |
US-2019189926-A1 | Coating Composition Comprising Compound, And Organic Light Emitting Device Comprising Same | 20170707 |
CN-109689799-B | Coating composition comprising compound and organic light emitting device comprising the same | 20170707 |
EP-3101002-A1 | Aryl sulfonic acid compound and use of same | 20140127 |
EP-3101002-B1 | Aryl sulfonic acid compound and use of same | 20140127 |
Complexity: | 501 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 4 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 365.94559812 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 8 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 365.94559812 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 152 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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