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2D Structure

tert-Butyl carbazate


  • SKU Code: CH140449
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Chemical Name - tert-Butyl carbazate
Mol Weight - 132.162
Smiles - CC(C)(C)OC(NN)=O
Property Name Property Value
Mol Nametert-Butyl carbazate
Molweight132.162
Monoisotopic Mass132.089878
Clogp-0.1116
Clogs-1.914
H Acceptors4
H Donors2
Total Surface Area108.42
Relative Psa0.45905
Polar Surface Area64.35
Druglikeness-39.247
Mutagenicnone
Tumorigenichigh
Reproductive Effectivelow
Irritantnone
Shape Index0.66667
Molecular Flexibility0.56018
Molecular Complexity0.48648
Fragments1
Non H Atoms9
Non Ch Atoms4
Electronegative Atoms4
Rotatable Bonds2
Sp3 Atoms6
Symmetric Atoms2
SmilesCC(C)(C)OC(NN)=O
InChIKeyInChI=1S/C5H12N2O2/c1-5(2,3)9-4(8)7-6/h6H2,1-3H3,(H,7,8)
InChIDKACXUFSLUYRFU-UHFFFAOYSA-N

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