Bis(2,4-dinitrophenyl) oxalate - CAS 16536-30-4
Catalog: |
BB012186 |
Product Name: |
Bis(2,4-dinitrophenyl) oxalate |
CAS: |
16536-30-4 |
Synonyms: |
bis(2,4-dinitrophenyl) oxalate |
IUPAC Name: | bis(2,4-dinitrophenyl) oxalate |
Description: | Bis(2,4-dinitrophenyl) oxalate (CAS# 16536-30-4 ) is a useful research chemical. |
Molecular Weight: | 422.22 |
Molecular Formula: | C14H6N4O12 |
Canonical SMILES: | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OC(=O)C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
InChI: | InChI=1S/C14H6N4O12/c19-13(29-11-3-1-7(15(21)22)5-9(11)17(25)26)14(20)30-12-4-2-8(16(23)24)6-10(12)18(27)28/h1-6H |
InChI Key: | CBZOGAWUNMFXFQ-UHFFFAOYSA-N |
Boiling Point: | 605.1 °C at 760 mmHg |
Density: | 1.759 g/cm3 |
Appearance: | Light yellow powder |
MDL: | MFCD00010712 |
LogP: | 3.92320 |
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 |
Publication Number | Title | Priority Date |
WO-2021188568-A1 | Method of detecting virus having hemagglutinin-esterase activity | 20200317 |
US-2021238155-A1 | Carbon monoxide prodrugs for the treatment of medical disorders | 20190328 |
WO-2019178247-A1 | Sensor devices and systems for monitoring markers in breath | 20180315 |
US-2021059560-A1 | Sensor devices and systems for monitoring markers in breath | 20180315 |
CN-109705851-A | A kind of organic matter makees the light emitting composition of filler | 20171026 |
PMID | Publication Date | Title | Journal |
21458634 | 20110408 | Kinetic-spectrometric three-dimensional chemiluminescence as an effective analytical tool. Application to the determination of benzo(a)pyrene | Analytica chimica acta |
20679722 | 20100801 | 3-Nitrophenol-4,4'-bipyridyl N,N'-dioxide (2/1): a DFT study and CSD analysis of DPNO molecular complexes | Acta crystallographica. Section C, Crystal structure communications |
15979786 | 20050930 | Establishment of process technology for the manufacture of dinitrogen pentoxide and its utility for the synthesis of most powerful explosive of today--CL-20 | Journal of hazardous materials |
15049638 | 20040402 | Kinetic study of the aminolysis and pyridinolysis of O-phenyl and O-ethyl O-(2,4-dinitrophenyl) thiocarbonates. A remarkable leaving group effect | The Journal of organic chemistry |
12895049 | 20030808 | Kinetic study of the phenolysis of O-methyl and O-phenyl O-2,4-dinitrophenyl thiocarbonates and O-ethyl 2,4-dinitrophenyl dithiocarbonate | The Journal of organic chemistry |
Complexity: | 673 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 421.99822164 |
Formal Charge: | 0 |
Heavy Atom Count: | 30 |
Hydrogen Bond Acceptor Count: | 12 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 421.99822164 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 236 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS