Home Other Building Blocks 4-ethyl-3-methyl-4H-1,2,4-triazole

4-ethyl-3-methyl-4H-1,2,4-triazole

CAS No.:
59781-02-1
Catalog Number:
AG01A93H
Molecular Formula:
C5H9N3
Molecular Weight:
111.1451
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A93H
Chemical Name:
4-ethyl-3-methyl-4H-1,2,4-triazole
CAS Number:
59781-02-1
Molecular Formula:
C5H9N3
Molecular Weight:
111.1451
MDL Number:
MFCD16622037
IUPAC Name:
4-ethyl-3-methyl-1,2,4-triazole
InChI:
InChI=1S/C5H9N3/c1-3-8-4-6-7-5(8)2/h4H,3H2,1-2H3
InChI Key:
RHYMIFQNKOJHON-UHFFFAOYSA-N
SMILES:
CCn1cnnc1C
Properties
Complexity:
74.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.08g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
111.148g/mol
Monoisotopic Mass:
111.08g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties