7-Bromo-1H-indole-2-carboxylic acid
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7-Bromo-1H-indole-2-carboxylic acid
structure -
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CAS No:
16732-71-1
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Formula:
C9H6BrNO2
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Chemical Name:
7-Bromo-1H-indole-2-carboxylic acid
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Synonyms:
1H-Indole-2-carboxylic acid,7-bromo-;Indole-2-carboxylic acid,7-bromo-;7-Bromo-1H-indole-2-carboxylic acid;7-Bromo-2-indolecarboxylic acid
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CAS No:
Characteristics
53.1
3
1.838±0.06 g/cm3(Predicted)
238-243°C
470.9±25.0 °C(Predicted)
238.6±23.2 °C
1.749
2-8°C
Safety Information
NONH for all modes of transport
3
36/38
26
Xi
P305 + P351 + P338
H315-H319
|Warning|H315 (97.44%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:240.05
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:238.95819
Monoisotopic Mass:238.95819
Topological Polar Surface Area:53.1
Heavy Atom Count:13
Complexity:222
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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7-Bromo-1H-indole-2-carboxylic acid
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