METHYL3-AMINOBENZO[B]THIOPHENE-2-CARBOXYLATE
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![METHYL3-AMINOBENZO[B]THIOPHENE-2-CARBOXYLATE structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/61d573c7ec7642878c6116b4a1b37a06.png "METHYL3-AMINOBENZO[B]THIOPHENE-2-CARBOXYLATE")
METHYL3-AMINOBENZO[B]THIOPHENE-2-CARBOXYLATE
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CAS No:
35212-85-2
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Formula:
C10H9NO2S
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Chemical Name:
METHYL3-AMINOBENZO[B]THIOPHENE-2-CARBOXYLATE
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Synonyms:
3-amino-1-benzothiophene-2-carboxylic acid methyl ester;Methyle3-aminobenzo[b]thiophene-2-carboxylate;methyl 3-aminobenzothiophene-2-carboxylate;3-Amino-benzo(b)-thiophene-2-carboxylic acid methylester;3-Amino-2-(methoxycarbonyl)-1-benzothiophene;3-amino-2-benzothiophenecarboxylic acid methyl ester;3-aminobenzothiophene-2-carboxylic acid methyl ester;Benzo[b]thiophene-2-carboxylic acid, 3-amino-, methyl ester
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CAS No:
METHYL3-AMINOBENZO[B]THIOPHENE-2-CARBOXYLATE Basic Attributes
207.25
207.03539970 g/mol
DTXSID90358022
2934999090
Characteristics
80.56000
2.85130
1.352±0.06 g/cm3
107-108°C
363.1±22.0 °C(Predicted)
173.4ºC
1.688
0.83±0.10
Safety Information
|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, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:207.25
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:207.03539970
Monoisotopic Mass:207.03539970
Topological Polar Surface Area:80.6
Heavy Atom Count:14
Complexity:234
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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