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(2S,3aS,7aS)-Octahydroindole-2-carboxylic acid, 98%

CAS: 80875-98-5 | C9H15NO2 | 169.224 g/mol

$134.33 - $381.30

Chemical Identifiers

CAS 80875-98-5
Molecular Formula C9H15NO2
Molecular Weight (g/mol) 169.224
MDL Number MFCD07782125
InChI Key CQYBNXGHMBNGCG-FXQIFTODSA-N
Synonym 2s,3as,7as-octahydro-1h-indole-2-carboxylic acid, 2s,3as,7as-octahydroindole-2-carboxylic acid, 2s,3as,7as-2-carboxyoctahydroindole, h-oic-oh, l-octahydroindole-2-carboxylic acid, unii-9id44u804i, 2-carboxyoctahydroindole, 2s,3as,7as, 1h-indole-2-carboxylic acid, octahydro-, 2s,3as,7as, 2s,3as,7as-2-carboxyperhydroindole, 2s,3as,7as-perhydroindole-2-carboxylic acid
PubChem CID 7408452
IUPAC Name (2S,3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxylic acid
SMILES C1CCC2C(C1)CC(N2)C(=O)O
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AAH2789403
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Thermo Scientific Chemicals
H2789403
1 g
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AAH2789406
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Thermo Scientific Chemicals
H2789406
5 g
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Description

Description

An intermediate in the synthesis of Perindopril. The completely diastereoselective α-alkylation of oxazolidinone provides a very convenient and concise route to enantiopure α-tetrasubstituted derivatives of this Oic stereoisomer.

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Applications
An intermediate in the synthesis of Perindopril. The completely diastereoselective α-alkylation of oxazolidinone provides a very convenient and concise route to enantiopure α-tetrasubstituted derivatives of this Oic stereoisomer.

Solubility
Soluble in methanol and water.

Notes
Store in cool place. Keep container tightly closed in a dry and well-ventilated place. Store away from strong oxidizing agents. Store at -20°C.
Specifications

Chemical Identifiers

80875-98-5
169.224
CQYBNXGHMBNGCG-FXQIFTODSA-N
7408452
C1CCC2C(C1)CC(N2)C(=O)O
C9H15NO2
MFCD07782125
2s,3as,7as-octahydro-1h-indole-2-carboxylic acid, 2s,3as,7as-octahydroindole-2-carboxylic acid, 2s,3as,7as-2-carboxyoctahydroindole, h-oic-oh, l-octahydroindole-2-carboxylic acid, unii-9id44u804i, 2-carboxyoctahydroindole, 2s,3as,7as, 1h-indole-2-carboxylic acid, octahydro-, 2s,3as,7as, 2s,3as,7as-2-carboxyperhydroindole, 2s,3as,7as-perhydroindole-2-carboxylic acid
(2S,3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxylic acid

Specifications

80875-98-5
C9H15NO2
1 g
Soluble in methanol and water.
−50 (c=1 in Methanol)
(2S,3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxylic acid
7408452
98%
266°C (decomposition)
MFCD07782125
2s,3as,7as-octahydro-1h-indole-2-carboxylic acid, 2s,3as,7as-octahydroindole-2-carboxylic acid, 2s,3as,7as-2-carboxyoctahydroindole, h-oic-oh, l-octahydroindole-2-carboxylic acid, unii-9id44u804i, 2-carboxyoctahydroindole, 2s,3as,7as, 1h-indole-2-carboxylic acid, octahydro-, 2s,3as,7as, 2s,3as,7as-2-carboxyperhydroindole, 2s,3as,7as-perhydroindole-2-carboxylic acid
CQYBNXGHMBNGCG-FXQIFTODSA-N
C1CCC2C(C1)CC(N2)C(=O)O
169.224
169.22
(2S,3aS,7aS)-Octahydroindole-2-carboxylic acid
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Safety and Handling

Safety and Handling

GHS H Statement
H315-H319-H335
Causes skin irritation.
Causes serious eye irritation.
May cause respiratory irritation.

P261-P264b-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P362-P501c

H315-H319-H335

TSCA : No

Recommended Storage : Ambient temperatures

SDS
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RUO – Research Use Only