Chem Diisopropyl Azodicarboxylate Gmfine

Compound 19
  CheckMol                        TMF02:r0:m0
MF=C8H14N2O4 MW=202.21
 14 13  0  0  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0118    1.5072   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2717    2.2609   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3188    2.2609   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5553    1.5190   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6259    1.5190   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8388    2.2727   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5435    0.0353   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9330    2.2727   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9448    3.7799   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2400    1.5308   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5471    2.2844   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5589    3.7917   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8542    1.5426   -0.0000 C   0  0  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  2  3  0  0  0
  5  7  1  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
M  END

Diisopropyl azodicarboxylate

₹ 0.00 0.00

Chemical Name - Diisopropyl azodicarboxylate
Mol Weight - 202.209
Smiles - CC(C)OC(N=NC(OC(C)C)=O)=O

Property Name	Property Value
Mol Name	Diisopropyl azodicarboxylate
Molweight	202.209
Monoisotopic Mass	202.095358
Clogp	1.8024
Clogs	-3.036
H Acceptors	6
Total Surface Area	166.06
Relative Psa	0.41611
Polar Surface Area	77.32
Druglikeness	-23.96
Mutagenic	low
Tumorigenic	low
Reproductive Effective	none
Irritant	none
Shape Index	0.71429
Molecular Flexibility	0.56514
Molecular Complexity	0.4722
Fragments	1
Non H Atoms	14
Non Ch Atoms	6
Electronegative Atoms	6
Rotatable Bonds	4
Sp3 Atoms	8
Symmetric Atoms	8
Smiles	CC(C)OC(N=NC(OC(C)C)=O)=O
InChIKey	InChI=1S/C8H14N2O4/c1-5(2)13-7(11)9-10-8(12)14-6(3)4/h5-6H,1-4H3
InChI	VVWRJUBEIPHGQF-UHFFFAOYSA-N

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Diisopropyl azodicarboxylate