Indole-3-acetone
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Indole-3-acetone
structure -
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CAS No:
1201-26-9
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Formula:
C11H11NO
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Chemical Name:
Indole-3-acetone
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Synonyms:
2-Propanone,1-(1H-indol-3-yl)-;2-Propanone,1-indol-3-yl-;2-Propanone,indol-3-yl-;1-(1H-Indol-3-yl)-2-propanone;Indole-3-acetone;Indol-3-yl-2-propanone;3-(2-Oxopropyl)indole;3-Indolylacetone;3-Acetonylindole;(1H-Indol-3-yl)acetone;NSC 100751;1-(1H-Indol-3-yl)propan-2-one
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CAS No:
Characteristics
32.9
1.36
tan
1.0898 (rough estimate)
116 °C
303.86°C (rough estimate)
168.4±28.4 °C
1.4950 (estimate)
2-8°C
7.93E-05mmHg at 25°C
Safety Information
3
Stable at normal temperatures and pressures.
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P322, P330, P337+P313, P363, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P322, P330, P337+P313, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:173.21
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:173.084063974
Monoisotopic Mass:173.084063974
Topological Polar Surface Area:32.9
Heavy Atom Count:13
Complexity:202
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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