METHYL 5-AMINO-1-BENZOTHIOPHENE-2-CARBOXYLATE
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METHYL 5-AMINO-1-BENZOTHIOPHENE-2-CARBOXYLATE
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CAS No:
20699-85-8
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Formula:
C10H9NO2S
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Chemical Name:
METHYL 5-AMINO-1-BENZOTHIOPHENE-2-CARBOXYLATE
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Synonyms:
2-carboxy-5-aminobenzo[b]thiophene methyl ester; 5-amino-benzo[b]thiophene-2-carboxylic acid methyl ester; methyl 5-aminobenzothiophene-2-carboxylate; Methyl 5-amino-1-benzothiophene-2-carboxylate; Methyl 5-aminobenzo[b]thiophene-2-carboxylate;
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CAS No:
METHYL 5-AMINO-1-BENZOTHIOPHENE-2-CARBOXYLATE Basic Attributes
207.24900
207.03539970
DTXSID40384972
2934999090
Characteristics
80.56000
2.85130
1.677g/cm3
178-179ºC
376.763ºC at 760 mmHg
181.66ºC
1.601
0mmHg at 25°C
Safety Information
R20/21/22; R36/37/38
S22-S26-S36/37/39
Xn
|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
XLogP3:2.4
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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