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CAS No.: | 83732-80-3 |
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Name: | 1-NAPHTHOL-3,8-DISULFONIC ACID DISODIUM SALT |
Molecular Structure: | |
Formula: | C10H6O7S2.2Na |
Molecular Weight: | 348.26 |
Synonyms: | 1,6-Naphthalenedisulfonicacid, 8-hydroxy-, disodium salt (9CI); |
EINECS: | 280-631-8 |
Density: | 1.816[at 20℃] |
Boiling Point: | 722.44℃[at 101 325 Pa] |
Solubility: | 797g/L |
PSA: | 151.39000 |
LogP: | 2.51520 |
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The 1-Naphthol-3,8-disulfonic acid disodium salt, with CAS registry number 83732-80-3, has the systematic name of disodium 8-hydroxynaphthalene-1,6-disulfonate. Besides this, it is also called 1,6-naphthalenedisulfonic acid, 8-hydroxy-, sodium salt (1:2). What's more, its system generated number is 0083732803.
Physical properties of 1-Naphthol-3,8-disulfonic acid disodium salt: (1)ACD/LogP: -1.93; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 7; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 134.73 Å2.
You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].[Na+].[O-]S(=O)(=O)c1cccc2cc(cc(O)c12)S([O-])(=O)=O
(2)InChI: InChI=1/C10H8O7S2.2Na/c11-8-5-7(18(12,13)14)4-6-2-1-3-9(10(6)8)19(15,16)17;;/h1-5,11H,(H,12,13,14)(H,15,16,17);;/q;2*+1/p-2
(3)InChIKey: KFHVAHCQOBQJQA-NUQVWONBAZ
(4)Std. InChI: InChI=1S/C10H8O7S2.2Na/c11-8-5-7(18(12,13)14)4-6-2-1-3-9(10(6)8)19(15,16)17;;/h1-5,11H,(H,12,13,14)(H,15,16,17);;/q;2*+1/p-2
(5)Std. InChIKey: KFHVAHCQOBQJQA-UHFFFAOYSA-L