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Home Carboxes 96-43-5
96-43-5,MFCD00005421
Catalog No.:AA0033D7

96-43-5 | 2-Chlorothiophene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
25g
99%
in stock  
$16.00   $11.00
- +
100g
99%
in stock  
$53.00   $37.00
- +
500g
98%
in stock  
$261.00   $183.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0033D7
Chemical Name:
2-Chlorothiophene
CAS Number:
96-43-5
Molecular Formula:
C4H3ClS
Molecular Weight:
118.5846
MDL Number:
MFCD00005421
SMILES:
Clc1cccs1
NSC Number:
8747
Properties
Properties
 
BP:
128.3°C at 760 mmHg  
Form:
Liquid  
MP:
-71.9 °C  
Refractive Index:
n20/D 1.547(lit.)  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
46.8  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
1  
XLogP3:
2.5  

Literature

Title: β-D-glucosyl conjugates of highly potent inhibitors of blood coagulation factor Xa bearing 2-chorothiophene as a P1 motif.

Journal: ChemMedChem 20120901

Title: Mechanistic studies on the Pd-catalyzed direct C-H arylation of 2-substituted thiophene derivatives with arylpalladium bipyridyl complexes.

Journal: Chemistry, an Asian journal 20120601

Title: Positive and negative photoion spectroscopy study of monochlorothiophenes.

Journal: The journal of physical chemistry. A 20111013

Title: (2E)-1-(5-Chloro-thio-phen-2-yl)-3-(2,3-dimeth-oxy-phen-yl)prop-2-en-1-one.

Journal: Acta crystallographica. Section E, Structure reports online 20111001

Title: (2E)-1-(5-Chloro-thio-phen-2-yl)-3-(2,4,5-trimeth-oxy-phen-yl)prop-2-en-1-one.

Journal: Acta crystallographica. Section E, Structure reports online 20110801

Title: Theoretical study on the electronic, structural, properties and reactivity of a series of mono-, di-, tri- and tetrachlorothiophenes as well as corresponding radical cation forms as monomers for conducting polymers.

Journal: Chemistry Central journal 20110101

Title: Entering the era of non-basic p1 site groups: discovery of Xarelto (Rivaroxaban).

Journal: Current topics in medicinal chemistry 20100101

Title: In vitro metabolism of rivaroxaban, an oral, direct factor Xa inhibitor, in liver microsomes and hepatocytes of rats, dogs, and humans.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20090501

Title: Emergence of new oral antithrombotics: a critical appraisal of their clinical potential.

Journal: Vascular health and risk management 20081201

Title: Discovery of the novel antithrombotic agent 5-chloro-N-({(5S)-2-oxo-3- [4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl}methyl)thiophene- 2-carboxamide (BAY 59-7939): an oral, direct factor Xa inhibitor.

Journal: Journal of medicinal chemistry 20050922

Title: Prediction of genotoxicity of chemical compounds by statistical learning methods.

Journal: Chemical research in toxicology 20050601

Title: Molecular structures of human factor Xa complexed with ketopiperazine inhibitors: preference for a neutral group in the S1 pocket.

Journal: Journal of medicinal chemistry 20030227

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