4-Hydroxynaphthalene-2-sulphonic acid - CAS 3771-14-0
Catalog: |
BB046766 |
Product Name: |
4-Hydroxynaphthalene-2-sulphonic acid |
CAS: |
3771-14-0 |
Synonyms: |
2-Naphthalenesulfonic acid, 4-hydroxy-; 1-Naphthol-3-sulfonic acid; 1-Naphthol, 3-sulfo-; 1-Hydroxy-3-naphthalenesulfonic acid; 4-Hydroxy-2-naphthalenesulfonic acid |
IUPAC Name: | 4-hydroxynaphthalene-2-sulfonic acid |
Description: | 4-Hydroxynaphthalene-2-sulphonic acid (CAS# 3771-14-0 ) is a useful research chemical. |
Molecular Weight: | 224.23 |
Molecular Formula: | C10H8O4S |
Canonical SMILES: | C1=CC=C2C(=C1)C=C(C=C2O)S(=O)(=O)O |
InChI: | InChI=1S/C10H8O4S/c11-10-6-8(15(12,13)14)5-7-3-1-2-4-9(7)10/h1-6,11H,(H,12,13,14) |
InChI Key: | HKWPUUYEGGDLJF-UHFFFAOYSA-N |
Purity: | ≥ 97 % |
Density: | 1.549±0.06 g/cm3 (Predicted) |
Complexity: | 319 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 224.01432991 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 224.01432991 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 83 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.2 |
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