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Home >> Chemical Listing >> Page 2440 >> 1-Isobutyl-1H-indole-3-carboxylic acid

1-Isobutyl-1H-indole-3-carboxylic acid
[CAS# 739365-10-7]

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Identification
Name 1-Isobutyl-1H-indole-3-carboxylic acid
Synonyms 1-(2-methylpropyl)-1H-indole-3-carboxylic acid; MFCD11155412
Molecular Structure CAS#: 739365-10-7, 1-Isobutyl-1H-indole-3-carboxylic acid
Molecular Formula C13H15NO2
Molecular Weight 217.26
CAS Registry Number 739365-10-7
SMILES OC(=O)c2cn(CC(C)C)c1ccccc12
InChI 1S/C13H15NO2/c1-9(2)7-14-8-11(13(15)16)10-5-3-4-6-12(10)14/h3-6,8-9H,7H2,1-2H3,(H,15,16)
InChIKey NIWSUEFMFADENR-UHFFFAOYSA-N
Properties
Density 1.153g/cm3 (Cal.)
Boiling point 401.08°C at 760 mmHg (Cal.)
Flash point 196.366°C (Cal.)
Refractive index 1.579 (Cal.)
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