1038358-79-0,MFCD11203766
Catalog No.:AA019SE4

1038358-79-0 | 5-(1-Chloroethyl)-3-(4h-1,2,4-triazol-3-yl)-1,2,4-oxadiazole

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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA019SE4
Chemical Name:
5-(1-Chloroethyl)-3-(4h-1,2,4-triazol-3-yl)-1,2,4-oxadiazole
CAS Number:
1038358-79-0
Molecular Formula:
C6H6ClN5O
Molecular Weight:
199.5977
MDL Number:
MFCD11203766
SMILES:
CC(c1onc(n1)c1nnc[nH]1)Cl
Properties
Computed Properties
 
Complexity:
182  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.7  

Literature
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SDS
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Tags:1038358-79-0 Molecular Formula|1038358-79-0 MDL|1038358-79-0 SMILES|1038358-79-0 5-(1-Chloroethyl)-3-(4h-1,2,4-triazol-3-yl)-1,2,4-oxadiazole
Catalog No.: AA019SE4
1038358-79-0,MFCD11203766
1038358-79-0 | 5-(1-Chloroethyl)-3-(4h-1,2,4-triazol-3-yl)-1,2,4-oxadiazole
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: AA019SE4
Chemical Name: 5-(1-Chloroethyl)-3-(4h-1,2,4-triazol-3-yl)-1,2,4-oxadiazole
CAS Number: 1038358-79-0
Molecular Formula: C6H6ClN5O
Molecular Weight: 199.5977
MDL Number: MFCD11203766
SMILES: CC(c1onc(n1)c1nnc[nH]1)Cl
Properties
Complexity: 182  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.7  
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