4,5-Dichlorophthalaldehyde

Product Information

Molecular Formula:
C8H4Cl2O2
Molecular Weight:
203.02
Synonyms
1,2-Benzenedicarboxaldehyde, 4,5-dichloro-; 4,5-dichlorobenzene-1,2-dicarbaldehyde
IUPAC Name
4,5-dichlorophthalaldehyde
Canonical SMILES
C1=C(C(=CC(=C1Cl)Cl)C=O)C=O
InChI
InChI=1S/C8H4Cl2O2/c9-7-1-5(3-11)6(4-12)2-8(7)10/h1-4H
InChI Key
UUAVOMUOLIKJHY-UHFFFAOYSA-N
Purity
98%

Safety Information

Hazards
H301-H335-H411-H314
Precautionary Statement
P260-P264-P270-P271-P273-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P391-P403+P233-P405-P501
Safety Class
8,6.1
GHS Pictogram
GHS05; GHS06; GHS09
Signal Word
Danger

Computed Properties

XLogP3
2.1
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
201.9588348
Monoisotopic Mass
201.9588348
Topological Polar Surface Area
34.1
Heavy Atom Count
12
Formal Charge
0
Complexity
164
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
CN-114375489-A Stimuli-responsive polymer films and formulations 2019-09-04
WO-2020243047-A1 Controlled heat delivery compositions 2019-05-24
US-2022218878-A1 Controlled heat delivery compositions 2019-05-24
US-2020390889-A1 Remotely triggered therapy 2019-02-21
US-2022362381-A1 Remotely triggered therapy 2019-02-21
JP-2022506084-A Method for purifying carbon nanotubes 2018-11-14
US-2014296544-A1 Cyclic peroxide oxidation of aromatic compounds production and use thereof 2013-03-27
KR-101337367-B1 Moisture-curable cast material composition and spray device containing the same 2011-07-04
KR-101381183-B1 Blending composition for the manufacture of vascular anastomosis device and vascular anastomosis device manufactured based on the same 2011-07-04
KR-20130004740-A Moisture-curable cast material composition and spray device containing the same 2011-07-04

Literatures

PMID Publication Date Title Journal
19219731 2009-01-01 The synthesis of analogs of shuangkangsu, a novel natural cycloperoxide glucoside from Lonicera japonica Thunb Journal of Asian natural products research
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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