616-21-7,MFCD00013676
Catalog No.:AA003DB9

616-21-7 | 1,2-Dichlorobutane

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
>96%(GC)
in stock  
$24.00   $17.00
- +
5g
96%
in stock  
$43.00   $30.00
- +
25g
>96.0%(GC)
in stock  
$45.00   $32.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003DB9
Chemical Name:
1,2-Dichlorobutane
CAS Number:
616-21-7
Molecular Formula:
C4H8Cl2
Molecular Weight:
127.0123
MDL Number:
MFCD00013676
SMILES:
CCC(CCl)Cl
NSC Number:
93880
Properties
Properties
 
BP:
124.1°C  

Computed Properties
 
Complexity:
28.7  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
0  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.4  

Literature

Title: Quantitative structure-activity relationships for toxicity and genotoxicity of halogenated aliphatic compounds: wing spot test of Drosophila melanogaster.

Journal: Chemosphere 20070201

Title: Recombination dynamics and hydrogen abstraction reactions of chlorine radicals in solution.

Journal: The journal of physical chemistry. A 20050519

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SDS
Tags:616-21-7 Molecular Formula|616-21-7 MDL|616-21-7 SMILES|616-21-7 1,2-Dichlorobutane
Catalog No.: AA003DB9
616-21-7,MFCD00013676
616-21-7 | 1,2-Dichlorobutane
Pack Size: 1g
Purity: >96%(GC)
in stock
$24.00 $17.00
Pack Size: 5g
Purity: 96%
in stock
$43.00 $30.00
Pack Size: 25g
Purity: >96.0%(GC)
in stock
$45.00 $32.00
Quantity
- +
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Technical Information
Catalog Number: AA003DB9
Chemical Name: 1,2-Dichlorobutane
CAS Number: 616-21-7
Molecular Formula: C4H8Cl2
Molecular Weight: 127.0123
MDL Number: MFCD00013676
SMILES: CCC(CCl)Cl
NSC Number: 93880
Properties
BP: 124.1°C  
Complexity: 28.7  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 6  
Hydrogen Bond Acceptor Count: 0  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.4  
Literature fold

Title: Quantitative structure-activity relationships for toxicity and genotoxicity of halogenated aliphatic compounds: wing spot test of Drosophila melanogaster.

Journal: Chemosphere20070201

Title: Recombination dynamics and hydrogen abstraction reactions of chlorine radicals in solution.

Journal: The journal of physical chemistry. A20050519

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