In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2005 | 14 | Yes |
Popular Name: 3,4-Dichloro-1-benzothiophene-2-carboxylic acid 3,4-Dichloro-1-benzothiophene-2-…
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CAS Numbers: , 34576-95-9 , [34576-95-9]
3,4-dichloro-1-benzothiophene-2-carboxylicacid
3,4-Dichloro-benzo[b]thiophene-2-carboxylic acid
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) | 3.95 | 7.32 | -49.7 | 0 | 2 | -1 | 40 | 246.094 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 273 - 275 | Enamine Building Blocks |
MP | 273...275 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Warnings | IRRITANT | Matrix Scientific |