Home Aminos 4-amino-1-ethyl-4,5-dihydro-1H-1,2,4-triazol-5-one

4-amino-1-ethyl-4,5-dihydro-1H-1,2,4-triazol-5-one

CAS No.:
1803598-66-4
Catalog Number:
AG01BCLI
Molecular Formula:
C4H8N4O
Molecular Weight:
128.1325
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Product Description
Catalog Number:
AG01BCLI
Chemical Name:
4-amino-1-ethyl-4,5-dihydro-1H-1,2,4-triazol-5-one
CAS Number:
1803598-66-4
Molecular Formula:
C4H8N4O
Molecular Weight:
128.1325
MDL Number:
MFCD28968178
IUPAC Name:
4-amino-2-ethyl-1,2,4-triazol-3-one
InChI:
InChI=1S/C4H8N4O/c1-2-8-4(9)7(5)3-6-8/h3H,2,5H2,1H3
InChI Key:
QPBCGWKNLXUFTF-UHFFFAOYSA-N
SMILES:
CCn1ncn(c1=O)N
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.07g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
128.135g/mol
Monoisotopic Mass:
128.07g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
61.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties