Basic information Safety Supplier Related

Octahydro-1H-indole-2-carboxylic acid

Basic information Safety Supplier Related

Octahydro-1H-indole-2-carboxylic acid Basic information

Product Name:
Octahydro-1H-indole-2-carboxylic acid
Synonyms:
  • OCTAHYDRO-INDOLE-2-CARBOXYLIC ACID
  • OCTAHYDRO-1H-INDOLE-2-CARBOXYLIC ACID
  • (S) OCTAHYDRO-1H-INDOLE-2-CARBOXYLIC ACID
  • H-OIC-OH
  • (2S,3ALPHA-S,7ALPHA-S)-OCTAHYDRO-1H-INDOLE-2-CARBOXYLIC ACID
  • (2S,3AS,7AS)-2-CARBOXYOCTAHYDROINDOLE
  • Octahydro-1H-2-carboxylic acid
  • OCTAHYDRO INDOLR-2-CARBOXYLIC ACID
CAS:
80828-13-3
MF:
C9H15NO2
MW:
169.22
Product Categories:
  • Chiral Reagents
  • Intermediates & Fine Chemicals
  • PYRROLE
  • pharmacetical
  • Indole
  • Pharmaceuticals
Mol File:
80828-13-3.mol
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Octahydro-1H-indole-2-carboxylic acid Chemical Properties

Melting point:
233-234 °C (decomp)(Solv: 1,4-dioxane (123-91-1); water (7732-18-5))
Boiling point:
318.6±25.0 °C(Predicted)
Density 
1.135±0.06 g/cm3(Predicted)
storage temp. 
-15°C
solubility 
Methanol (Slightly), Water (Slightly)
form 
Solid
pka
2.47±0.20(Predicted)
color 
White to Off-White
InChI
InChI=1/C9H15NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h6-8,10H,1-5H2,(H,11,12)/t6-,7-,8-/s3
InChIKey
CQYBNXGHMBNGCG-VTCOHLDGNA-N
SMILES
N1[C@@]2([H])[C@]([H])(CCCC2)C[C@@H]1C(O)=O |&1:1,3,10,r|
CAS DataBase Reference
80828-13-3(CAS DataBase Reference)
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Octahydro-1H-indole-2-carboxylic acid Usage And Synthesis

Chemical Properties

White Crystalline Solid

Uses

(2R,3aR,7aR)-rel-OctahydroIndole-2-carboxylic Acid is a reactant in the preparation of Perindoprilat (P287530), an angiotensin-converting enzyme (ACE) inhibitor. Antihypertensive.

Uses

Trandolapril intermediate

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