| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 11th, 2006 | 12 | Yes |
Popular Name: (2S,3AS,7AS)-Octahydro-1H-indole-2-carboxylic acid (2S,3AS,7AS)-Octahydro-1H-indole…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 186194-75-2 , 80828-13-3 , 80875-98-5 , [80828-13-3] , [80875-98-5] , [N/A]
"L-Octahydroindole-2-carboxylic acid, 98%"
(2S)-Octahydro-1H-indole-2-carboxylic acid
(2S,3AS,7AS)-2-Carboxyoctahydroindole
(2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic acid, 98%+
(2S,3aS,7aS)-Octahydro-1H-indole-2-carboxylic acid; (Intermediates for Perindopril)
(2S,3aS,7aS)-Octahydroindole-2-carboxylic acid
(2S,3aS,7aS)-Octahydroindole-2-carboxylic acid, 98%
(2S,3aS,7aS)-Perhydroindole-2-carboxylic acid
(2S,3aS,7aS)octahydro-1H-indole-2-carboxylic acid
1H-Indole-2-carboxylic acid, octahydro-, (2S)- (9CI)
1H-Indole-2-carboxylic acid, octahydro-, (2S,3aS,7aS)- (9CI)
L-Octahydroindole-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) | 0.68 | 3.97 | -38.77 | 2 | 3 | 0 | 57 | 169.224 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.55 | 3.31 | -6.81 | 1 | 2 | 0 | 29 | 261.062 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 210 - 212 | Enamine Building Blocks |
| MP | 255°(dec.) | Oakwood Chemical |
| Melting_Point | 266? dec. | Alfa-Aesar |
| Melting_Point | 266° dec. | Alfa-Aesar |
| MP | 266°dec. | Matrix Scientific |
| MP | 268 - 270 | Enamine Building Blocks |
| MP | 268...270 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
