408314-20-5,MFCD01114754
Catalog No.:AA01BA80

408314-20-5 | 3,5-dibromo-1lambda6-thiane-1,1,4-trione

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  • Properties
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Technical Information
Catalog Number:
AA01BA80
Chemical Name:
3,5-dibromo-1lambda6-thiane-1,1,4-trione
CAS Number:
408314-20-5
Molecular Formula:
C5H6Br2O3S
Molecular Weight:
305.9723
MDL Number:
MFCD01114754
SMILES:
O=C1C(Br)CS(=O)(=O)CC1Br
NSC Number:
135444
Properties
Computed Properties
 
Complexity:
246  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.8  

Literature
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SDS
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Tags:408314-20-5 Molecular Formula|408314-20-5 MDL|408314-20-5 SMILES|408314-20-5 3,5-dibromo-1lambda6-thiane-1,1,4-trione
Catalog No.: AA01BA80
408314-20-5,MFCD01114754
408314-20-5 | 3,5-dibromo-1lambda6-thiane-1,1,4-trione
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA01BA80
Chemical Name: 3,5-dibromo-1lambda6-thiane-1,1,4-trione
CAS Number: 408314-20-5
Molecular Formula: C5H6Br2O3S
Molecular Weight: 305.9723
MDL Number: MFCD01114754
SMILES: O=C1C(Br)CS(=O)(=O)CC1Br
NSC Number: 135444
Properties
Complexity: 246  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 2  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.8  
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