Chemical ID: 4662118

c1[nH]c(=O)[nH]n1
Chemical ID:
4662118
Name [?]:
2,4-dihydro-1,2,4-triazol-3-one
SMILES [?]:
c1[nH]c(=O)[nH]n1
InChi [?]:
InChI=1/C2H3N3O/c6-2-3-1-4-5-2/h1H,(H2,3,4,5,6)
InChi Info:
AuxInfo=1/1/N:1,3,2,6,5,4/rA:6nCNCONN/rB:s1;s2;d3;s3;d1s5;/rC:;;;;;;

Chemical Details

Atom Count
Formula:C2H3N3O
All Atoms:6
Heavy Atoms:6
Chiral Atoms:0
ZAP Information [?]
Total:3.46534
Area:210.77
Solvation:-1.8039
Coulombic:-31.5735
Bond Count [?]
All:6
Single:4
Double:2
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:85.0648
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:-0.17
LogP (Chemaxon):-0.41

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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