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667413-68-5,MFCD04054633
Catalog No.:AA00FBR2

667413-68-5 | 4-Allyl-5-[1-(3-methylphenoxy)ethyl]-4h-1,2,4-triazole-3-thiol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$172.00   $120.00
- +
5g
95%
in stock  
$685.00   $479.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00FBR2
Chemical Name:
4-Allyl-5-[1-(3-methylphenoxy)ethyl]-4h-1,2,4-triazole-3-thiol
CAS Number:
667413-68-5
Molecular Formula:
C14H17N3OS
Molecular Weight:
275.3693
MDL Number:
MFCD04054633
SMILES:
C=CCn1c(S)nnc1C(Oc1cccc(c1)C)C
Properties
Computed Properties
 
Complexity:
383  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
5  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.1  

Literature
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SDS
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Tags:667413-68-5 Molecular Formula|667413-68-5 MDL|667413-68-5 SMILES|667413-68-5 4-Allyl-5-[1-(3-methylphenoxy)ethyl]-4h-1,2,4-triazole-3-thiol
Catalog No.: AA00FBR2
667413-68-5,MFCD04054633
667413-68-5 | 4-Allyl-5-[1-(3-methylphenoxy)ethyl]-4h-1,2,4-triazole-3-thiol
Pack Size： 1g
Purity： 95%
in stock
$172.00 $120.00
Pack Size： 5g
Purity： 95%
in stock
$685.00 $479.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00FBR2
Chemical Name: 4-Allyl-5-[1-(3-methylphenoxy)ethyl]-4h-1,2,4-triazole-3-thiol
CAS Number: 667413-68-5
Molecular Formula: C14H17N3OS
Molecular Weight: 275.3693
MDL Number: MFCD04054633
SMILES: C=CCn1c(S)nnc1C(Oc1cccc(c1)C)C
Properties
Complexity: 383  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 19  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 5  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.1  
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