5-Bromoindole-2-carboxylic acid methyl ester
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5-Bromoindole-2-carboxylic acid methyl ester
structure -
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CAS No:
210345-56-5
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Formula:
C10H8BrNO2
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Chemical Name:
5-Bromoindole-2-carboxylic acid methyl ester
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Synonyms:
5-BROMOINDOLE-2-CARBOXYLIC ACID METHYL ESTER;1H-Indole-2-carboxylic acid, 5-broMo-, Methyl ester;ZERO/005613;ZINC00499439;Methyl 5-bromoindole-2-carboxyate
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CAS No:
5-Bromoindole-2-carboxylic acid methyl ester Basic Attributes
254.08
252.973831
DTXSID50358760
2933990090
Characteristics
42.1
3.43
1.6±0.1 g/cm3
211.8-213.6 °C(Solv: toluene (108-88-3))
386.2±22.0 °C at 760 mmHg
187.3±22.3 °C
1.666
3.61E-06mmHg at 25°C
Computed Properties
Molecular Weight:254.08
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:252.97384
Monoisotopic Mass:252.97384
Topological Polar Surface Area:42.1
Heavy Atom Count:14
Complexity:234
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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5-Bromoindole-2-carboxylic acid methyl ester
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