| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 16 | No |
Popular Name: methyl 2-amino-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate methyl 2-amino-4,5,6,7,8,9-hexah…
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CAS Number: 350996-90-6
2-AMINO-4,5,6,7,8,9-HEXAHYDRO-CYCLOOCTA[B]-THIOPHENE-3-CARBOXYLIC ACID METHYL ESTER
2-Amino-4,5,6,7,8,9-hexahydrocycloocta[b] thiophene-3-carboxylic acid methyl ester
2-Amino-4,5,6,7,8,9-hexahydrocycloocta[b]-
2-Amino-4,5,6,7,8,9-hexahydrocycloocta[b]-thiophene-3-carboxylic acid methyl ester
Methyl 2-amino-4,5,6,7,8,9-hexahydrocycloocta-[b]thiophene-3-carboxylate
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.15 | -0.76 | -7.03 | 2 | 3 | 0 | 52 | 239.34 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.