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Home >> Chemical Listing >> Page 2903 >> (3-Butyryl-1H-indol-1-yl)acetic acid

(3-Butyryl-1H-indol-1-yl)acetic acid
[CAS# 892676-98-1]

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Identification
Name (3-Butyryl-1H-indol-1-yl)acetic acid
Synonyms (3-butanoyl-1H-indol-1-yl)acetic acid; MFCD08676634
Molecular Structure CAS#: 892676-98-1, (3-Butyryl-1H-indol-1-yl)acetic acid
Molecular Formula C14H15NO3
Molecular Weight 245.27
CAS Registry Number 892676-98-1
SMILES O=C(c2c1ccccc1n(c2)CC(=O)O)CCC
InChI 1S/C14H15NO3/c1-2-5-13(16)11-8-15(9-14(17)18)12-7-4-3-6-10(11)12/h3-4,6-8H,2,5,9H2,1H3,(H,17,18)
InChIKey MWJZDOGFNNCVNW-UHFFFAOYSA-N
Properties
Density 1.21g/cm3 (Cal.)
Boiling point 461.805°C at 760 mmHg (Cal.)
Flash point 233.091°C (Cal.)
Refractive index 1.589 (Cal.)
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