methyl 3-(acetyloxy)-4,6-dinitro-1-benzothiophene-2-carboxylate

Chemical Structure Depiction of
methyl 3-(acetyloxy)-4,6-dinitro-1-benzothiophene-2-carboxylate
Available: 46 mg
Amount:
mg
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Compound characteristics

Compound ID: 8013-1524
Compound Name: methyl 3-(acetyloxy)-4,6-dinitro-1-benzothiophene-2-carboxylate
Molecular Weight: 340.27
Molecular Formula: C12 H8 N2 O8 S
Smiles: CC(=O)Oc1c2c(cc(cc2sc1C(=O)OC)[N+]([O-])=O)[N+]([O-])=O
Stereo: ACHIRAL
logP: 2.3448
logD: 2.3448
logSw: -2.5519
Hydrogen bond acceptors count: 14
Polar surface area: 109.546
InChI Key: JBEALWVCMTVPEC-UHFFFAOYSA-N
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