6-Bromo-1H-indole-2-carboxylic acid
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6-Bromo-1H-indole-2-carboxylic acid
structure -
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CAS No:
16732-65-3
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Formula:
C9H6BrNO2
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Chemical Name:
6-Bromo-1H-indole-2-carboxylic acid
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Synonyms:
1H-Indole-2-carboxylic acid,6-bromo-;Indole-2-carboxylic acid,6-bromo-;6-Bromo-1H-indole-2-carboxylic acid;6-Bromoindol-2-carboxylic acid;6-Bromoindole-2-carboxylic acid
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CAS No:
Characteristics
53.1
3
Solid
1.838±0.06 g/cm3(Predicted)
220-224 °C
470.9±25.0 °C(Predicted)
238.6±23.2 °C
1.749
1.13E-09mmHg at 25°C
Safety Information
IRRITANT
36/37/38
36/37/39
Xi
P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 3 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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6-Bromo-1H-indole-2-carboxylic acid
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