Home Other Building Blocks 5-(difluoromethyl)-3-methyl-1H-1,2,4-triazole

5-(difluoromethyl)-3-methyl-1H-1,2,4-triazole

CAS No.:
1094760-03-8
Catalog Number:
AG01BH1A
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01BH1A
Chemical Name:
5-(difluoromethyl)-3-methyl-1H-1,2,4-triazole
CAS Number:
1094760-03-8
MDL Number:
MFCD11215032
IUPAC Name:
3-(difluoromethyl)-5-methyl-1H-1,2,4-triazole
InChI:
InChI=1S/C4H5F2N3/c1-2-7-4(3(5)6)9-8-2/h3H,1H3,(H,7,8,9)
InChI Key:
PFTVXFCTPWXITA-UHFFFAOYSA-N
Properties
Complexity:
97.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.045g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
133.102g/mol
Monoisotopic Mass:
133.045g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties