methylindoline-5-carboxylate
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methylindoline-5-carboxylate
structure -
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CAS No:
141452-01-9
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Formula:
C10H11NO2
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Chemical Name:
methylindoline-5-carboxylate
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Synonyms:
1H-Indole-5-carboxylicacid, 2,3-dihydro-, methyl ester;methyl indoline-5-carboxylate;Methyl 2,3-dihydro-1H-indole-5-carboxylate;2,3-Dihydro-1H-indol-5-carboxylic acid methyl ester
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CAS No:
Characteristics
38.33000
1.57920
1.162±0.06 g/cm3
67-69 °C
331.0±31.0 °C(Predicted)
153.956ºC
1.555
0mmHg at 25°C
2.65±0.20
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:177.20
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:177.078978594
Monoisotopic Mass:177.078978594
Topological Polar Surface Area:38.3
Heavy Atom Count:13
Complexity:205
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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