Chem Ethyl 4 Pyrazolecarboxylate

Compound 39
  CheckMol                        TMF02:r0:m0
MF=C6H8N2O2 MW=140.14
 10 10  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0119   -1.4934   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3274   -2.2401   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2800   -2.2401   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6430   -1.4815   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6430   -1.6119   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.4223   -3.7216   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9586   -2.2282   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6386   -2.7141   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
    2.8801   -4.0179   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6 01  0  1  0  0
  4  7 02  0  1  0  0
  5  8  1  0  0  0  0
  6  9 02  0  1  0  0
  7 10 01  0  1  0  0
  9 10 01  0  1  0  0
M  END

Ethyl 4 Pyrazolecarboxylate

₹ 0.00 0.00

Chemical Name - Ethyl 4 Pyrazolecarboxylate
Mol Weight - 140.142
Smiles -

Property Name	Property Value
Mol Name	Ethyl 4 Pyrazolecarboxylate
Molweight	140.142
Monoisotopic Mass	140.058578
Clogp	-0.1275
Clogs	-0.63
H Acceptors	4
H Donors	1
Total Surface Area	115.36
Relative Psa	0.41609
Polar Surface Area	54.98
Druglikeness	-1.1451
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.7
Molecular Flexibility	0.48575
Molecular Complexity	0.64378
Non H Atoms	10
Non Ch Atoms	4
Electronegative Atoms	4
Rotatable Bonds	3
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	5
Sp3 Atoms	3
Aromatic Nitrogens	2
Smiles

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Ethyl 4 Pyrazolecarboxylate