1,8-Diaminonaphthalene - CAS 479-27-6
Catalog: |
BB026434 |
Product Name: |
1,8-Diaminonaphthalene |
CAS: |
479-27-6 |
Synonyms: |
naphthalene-1,8-diamine |
IUPAC Name: | naphthalene-1,8-diamine |
Description: | 1,8-Diaminonaphthalene (CAS# 479-27-6) is used as a reagent/ligand in the synthesis of transition metal tetraazamacrocyclic complexes as potent antimicrobial and antioxidant agents. |
Molecular Weight: | 158.20 |
Molecular Formula: | C10H10N2 |
Canonical SMILES: | C1=CC2=C(C(=C1)N)C(=CC=C2)N |
InChI: | InChI=1S/C10H10N2/c11-8-5-1-3-7-4-2-6-9(12)10(7)8/h1-6H,11-12H2 |
InChI Key: | YFOOEYJGMMJJLS-UHFFFAOYSA-N |
Boiling Point: | 205 ℃ (12 mmHg) |
Melting Point: | 63-66 ℃ |
Purity: | Techincal grade |
Density: | 1.1265 g/cm3 |
Appearance: | Off white powder |
Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00004033 |
LogP: | 3.16660 |
Vapor Pressure: | 0.0000293 [mmHg] |
GHS Hazard Statement: | H302 (98.53%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P201, P202, P261, P264, P270, P272, P273, P280, P281, P301+P312, P302+P352, P308+P313, P321, P330, P333+P313, P363, P391, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
23072544 | 20121102 | Extended hydrogen bond network enabled superbases | Organic letters |
22553985 | 20120521 | A series of oxyimine-based macrocyclic dinuclear zinc(II) complexes enhances phosphate ester hydrolysis, DNA binding, DNA hydrolysis, and lactate dehydrogenase inhibition and induces apoptosis | Inorganic chemistry |
22324789 | 20120302 | Synthesis and photophysical properties of aryl-substituted 2-borylbenzaldimines and their extended π-conjugated congeners | The Journal of organic chemistry |
22187045 | 20120221 | Diborane(4) compounds with bidentate diamino groups | Dalton transactions (Cambridge, England : 2003) |
21719303 | 20110902 | Synthesis, spectroscopic and electrochemical studies of N,N-bis[(E)-2-thienylmethylidene]-1,8-naphthalenediamine and its Cu(II) complex: DNA cleavage and generation of superoxide anion | Journal of photochemistry and photobiology. B, Biology |
Complexity: | 142 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 158.084398327 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 158.084398327 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 52 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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