4-tert-butylcyclohexyl (3-nitro-1H-1,2,4-triazol-1-yl)acetate

Chemical Structure Depiction of
4-tert-butylcyclohexyl (3-nitro-1H-1,2,4-triazol-1-yl)acetate
Available: 2 mg
Amount:
mg
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Compound characteristics

Compound ID: 6228-0800
Compound Name: 4-tert-butylcyclohexyl (3-nitro-1H-1,2,4-triazol-1-yl)acetate
Molecular Weight: 310.35
Molecular Formula: C14 H22 N4 O4
Smiles: CC(C)(C)C1CCC(CC1)OC(Cn1cnc(n1)[N+]([O-])=O)=O
Stereo: ACHIRAL
logP: 3.1276
logD: 3.1276
logSw: -2.7603
Hydrogen bond acceptors count: 9
Polar surface area: 76.395
InChI Key: DJYKREWLJFTORF-UHFFFAOYSA-N
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