Home Carbonyls 1,3-Benzenedicarbonyl chloride

1,3-Benzenedicarbonyl chloride

CAS No.:
99-63-8
Catalog Number:
AG0039NF
Molecular Formula:
C8H4Cl2O2
Molecular Weight:
203.0222
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Product Description
Catalog Number:
AG0039NF
Chemical Name:
1,3-Benzenedicarbonyl chloride
CAS Number:
99-63-8
Molecular Formula:
C8H4Cl2O2
Molecular Weight:
203.0222
MDL Number:
MFCD00000678
IUPAC Name:
benzene-1,3-dicarbonyl chloride
InChI:
InChI=1S/C8H4Cl2O2/c9-7(11)5-2-1-3-6(4-5)8(10)12/h1-4H
InChI Key:
FDQSRULYDNDXQB-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cccc(c1)C(=O)Cl
EC Number:
202-774-7
UNII:
6A3LDJ6CL3
NSC Number:
41884
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.959g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.018g/mol
Monoisotopic Mass:
201.959g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Literature
Title Journal
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A new bis(rhodamine)-based fluorescent chemosensor for Fe3+. Journal of fluorescence 20120501
Dibenzyl-aza-nium chloride. Acta crystallographica. Section E, Structure reports online 20120301
Binding of group 15 and group 16 oxides by a concave host containing an isophthalamide unit. Beilstein journal of organic chemistry 20120101
Dicyclo-hexyl-ammonium thio-cyanate: monoclinic polymorph. Acta crystallographica. Section E, Structure reports online 20111101
Study on morphology and characterization of poly(mphenylene isophtalamide)/multi-walled carbon nanotubes composite nanofibers by electrospinning. Journal of nanoscience and nanotechnology 20110501
1-{3-[(4-Oxopiperidin-1-yl)carbon-yl]benzoyl}piperidin-4-one. Acta crystallographica. Section E, Structure reports online 20100801
Synthesis and characterization of aromatic-aliphatic polyamide nanocomposite films incorporating a thermally stable organoclay. Nanoscale research letters 20090101
Hydrolytic stability of terephthaloyl chloride and isophthaloyl chloride. Environmental science & technology 20061015
A newly synthesized macrocyclic dithioxamide receptor for phosphate sensing. Talanta 20060615
Imide linked '4 + 4' macrocycles formed by condensation of isophthaloyl dichloride and tetra- or penta-fluoroaniline. Chemical communications (Cambridge, England) 20040607
Properties