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Home >> Chemical Listing >> Page 1995 >> (3aS,7aS)-3a,4,5,6,7,7a-Hexahydro-3H-indole-2-carboxylic acid

(3aS,7aS)-3a,4,5,6,7,7a-Hexahydro-3H-indole-2-carboxylic acid
[CAS# 612069-05-3]

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Identification
Name (3aS,7aS)-3a,4,5,6,7,7a-Hexahydro-3H-indole-2-carboxylic acid
Synonyms (3aS,7aS)-3a,4,5,6,7,7a-hexahydro-3H-indole-2-carboxylic acid
Molecular Structure CAS#: 612069-05-3, (3aS,7aS)-3a,4,5,6,7,7a-Hexahydro-3H-indole-2-carboxylic acid
Molecular Formula C9H13NO2
Molecular Weight 167.21
CAS Registry Number 612069-05-3
SMILES O=C(O)/C1=N/[C@H]2CCCC[C@H]2C1
InChI 1S/C9H13NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h6-7H,1-5H2,(H,11,12)/t6-,7-/m0/s1
InChIKey GATFTDQNIWULCV-BQBZGAKWSA-N
Properties
Density 1.39g/cm3 (Cal.)
Boiling point 319.1°C at 760 mmHg (Cal.)
Flash point 146.8°C (Cal.)
Refractive index 1.65 (Cal.)
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