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322412-27-1,MFCD00618584
Catalog No.:AA00C5SB

322412-27-1 | 4-Allyl-5-(3-methylphenyl)-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:
AA00C5SB
Chemical Name:
4-Allyl-5-(3-methylphenyl)-4h-1,2,4-triazole-3-thiol
CAS Number:
322412-27-1
Molecular Formula:
C12H13N3S
Molecular Weight:
231.3167
MDL Number:
MFCD00618584
SMILES:
C=CCn1c(S)nnc1c1cccc(c1)C
Properties
Computed Properties
 
Complexity:
324  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.6  

Literature
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SDS
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Tags:322412-27-1 Molecular Formula|322412-27-1 MDL|322412-27-1 SMILES|322412-27-1 4-Allyl-5-(3-methylphenyl)-4h-1,2,4-triazole-3-thiol
Catalog No.: AA00C5SB
322412-27-1,MFCD00618584
322412-27-1 | 4-Allyl-5-(3-methylphenyl)-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: AA00C5SB
Chemical Name: 4-Allyl-5-(3-methylphenyl)-4h-1,2,4-triazole-3-thiol
CAS Number: 322412-27-1
Molecular Formula: C12H13N3S
Molecular Weight: 231.3167
MDL Number: MFCD00618584
SMILES: C=CCn1c(S)nnc1c1cccc(c1)C
Properties
Complexity: 324  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.6  
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