Home Other Building Blocks 4-Ethyl-4H-1,2,4-triazole

4-Ethyl-4H-1,2,4-triazole

CAS No.:
43183-55-7
Catalog Number:
AG00DU22
Molecular Formula:
C4H7N3
Molecular Weight:
97.1185
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Product Description
Catalog Number:
AG00DU22
Chemical Name:
4-Ethyl-4H-1,2,4-triazole
CAS Number:
43183-55-7
Molecular Formula:
C4H7N3
Molecular Weight:
97.1185
MDL Number:
MFCD24197082
IUPAC Name:
4-ethyl-1,2,4-triazole
InChI:
InChI=1S/C4H7N3/c1-2-7-3-5-6-4-7/h3-4H,2H2,1H3
InChI Key:
SEAZNTDWFMFOKA-UHFFFAOYSA-N
SMILES:
CCn1cnnc1
Properties
Complexity:
48.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
97.064g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
97.121g/mol
Monoisotopic Mass:
97.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties