2-Hydroxy-1-(2-hydroxy-4-sulfo-1-naphthylazo)-3-naphthoic Acid - CAS 3737-95-9
Catalog: |
BB023264 |
Product Name: |
2-Hydroxy-1-(2-hydroxy-4-sulfo-1-naphthylazo)-3-naphthoic Acid |
CAS: |
3737-95-9 |
Synonyms: |
3-hydroxy-4-[(2-hydroxy-4-sulfo-1-naphthalenyl)azo]-2-naphthalenecarboxylic acid; 3-hydroxy-4-[(2-hydroxy-4-sulfonaphthalen-1-yl)diazenyl]naphthalene-2-carboxylic acid |
IUPAC Name: | 3-hydroxy-4-[(2-hydroxy-4-sulfonaphthalen-1-yl)diazenyl]naphthalene-2-carboxylic acid |
Description: | 2-Hydroxy-1-(2-hydroxy-4-sulfo-1-naphthylazo)-3-naphthoic Acid (CAS# 3737-95-9) is used in preparation method of Hydrophilic modified Hexagonal Boron Nitride (h-BN). |
Molecular Weight: | 438.41 |
Molecular Formula: | C21H14N2O7S |
Canonical SMILES: | C1=CC=C2C(=C1)C=C(C(=C2N=NC3=C(C=C(C4=CC=CC=C43)S(=O)(=O)O)O)O)C(=O)O |
InChI: | InChI=1S/C21H14N2O7S/c24-16-10-17(31(28,29)30)13-7-3-4-8-14(13)18(16)22-23-19-12-6-2-1-5-11(12)9-15(20(19)25)21(26)27/h1-10,24-25H,(H,26,27)(H,28,29,30) |
InChI Key: | MVQBFZXBLLMXGS-UHFFFAOYSA-N |
Density: | 1.6 g/cm3 |
Appearance: | Very dark violet to black powder |
MDL: | MFCD00004078 |
LogP: | 5.84530 |
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 |
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Complexity: | 798 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 438.05217196 |
Formal Charge: | 0 |
Heavy Atom Count: | 31 |
Hydrogen Bond Acceptor Count: | 9 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 438.05217196 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 165 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.3 |
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