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128016-39-7,MFCD30530140
Catalog No.:AA01F5ET

128016-39-7 | 2-{[5-(Dodecylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetic acid

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contact us at [email protected] for pricing and availability information.
  • Technical Information
  • Properties
  • Literature
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Technical Information
Catalog Number:
AA01F5ET
Chemical Name:
2-{[5-(Dodecylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetic acid
CAS Number:
128016-39-7
Molecular Formula:
C16H28N2O2S3
Molecular Weight:
376.6007
MDL Number:
MFCD30530140
SMILES:
CCCCCCCCCCCCSc1nnc(s1)SCC(=O)O
Properties
Computed Properties
 
Complexity:
309  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
15  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
7.2  

Literature
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SDS
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Tags:128016-39-7 Molecular Formula|128016-39-7 MDL|128016-39-7 SMILES|128016-39-7 2-{[5-(Dodecylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetic acid
Catalog No.: AA01F5ET
128016-39-7,MFCD30530140
128016-39-7 | 2-{[5-(Dodecylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetic acid
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: AA01F5ET
Chemical Name: 2-{[5-(Dodecylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetic acid
CAS Number: 128016-39-7
Molecular Formula: C16H28N2O2S3
Molecular Weight: 376.6007
MDL Number: MFCD30530140
SMILES: CCCCCCCCCCCCSc1nnc(s1)SCC(=O)O
Properties
Complexity: 309  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 23  
Hydrogen Bond Acceptor Count: 7  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 15  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 7.2  
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