1,5-Dinitroanthraquinone - CAS 82-35-9
Catalog: |
BB036799 |
Product Name: |
1,5-Dinitroanthraquinone |
CAS: |
82-35-9 |
Synonyms: |
1,5-dinitroanthracene-9,10-dione |
IUPAC Name: | 1,5-dinitroanthracene-9,10-dione |
Description: | 1,5-Dinitroanthraquinone (CAS# 82-35-9) is a useful research chemical. |
Molecular Weight: | 298.21 |
Molecular Formula: | C14H6N2O6 |
Canonical SMILES: | C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-] |
InChI: | InChI=1S/C14H6N2O6/c17-13-7-3-1-5-9(15(19)20)11(7)14(18)8-4-2-6-10(12(8)13)16(21)22/h1-6H |
InChI Key: | XVMVHWDCRFNPQR-UHFFFAOYSA-N |
Boiling Point: | 563.4 °C at 760 mmHg |
Melting Point: | 250 °C (dec.)(lit.) |
Purity: | 95 % |
Density: | 1.631 g/cm3 |
LogP: | 3.32480 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113304763-A | Catalyst for preparing aminoanthraquinone through hydrogenation, preparation method and application thereof | 20210610 |
CN-112552707-A | Method for producing disperse dye by using 1-aminoanthraquinone DMF residue | 20201218 |
CN-112390720-A | Method for synthesizing 1, 5-dinitroanthraquinone by continuous flow microchannel reactor | 20201127 |
CN-112409185-A | Method for synthesizing dinitroanthraquinone by continuous flow microchannel reactor | 20201127 |
CN-111423329-A | Resource utilization method of waste residue generated in production of 1-nitroanthraquinone by solvent method | 20200514 |
Complexity: | 488 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 298.02258592 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 298.02258592 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 126 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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