Structure

Methyl 3-amino-1-benzothiophene-2-carboxylate

CAS
35212-85-2
Catalog Number
ACM35212852
Category
Other Products
Molecular Weight
207.24896
Molecular Formula
C10H9NO2S

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Specification

Synonyms
3-Amino-benzo(b)-thiophene-2-carboxylic acid methylester
IUPAC Name
methyl 3-amino-1-benzothiophene-2-carboxylate
SMILES
COC(=O)C1=C(C2=CC=CC=C2S1)N
InChI Key
VLHHEYMZLXKSQO-UHFFFAOYSA-N
Boiling Point
363.1ºC at 760 mmHg
Melting Point
107-108ºC
Flash Point
173.4ºC
Density
1.352g/cm³
Exact Mass
207.03500
H-Bond Acceptor
3
H-Bond Donor
1

Downstream Synthesis Route 1

  • 35212-85-2
  • 77287-34-4
  • 36822-08-9

Reference: [1]Journal of Organic Chemistry,1973,vol. 38,p. 2450 - 2452
[2]Bioorganic and medicinal chemistry,2012,vol. 20,p. 6724 - 6731,8

Downstream Synthesis Route 2

  • 696-59-3
  • 35212-85-2
  • 80066-96-2

Reference: [1]Synthesis,1981,vol. No.9,p. 710 - 711

Downstream Synthesis Route 3

  • 1943-83-5
  • 35212-85-2
  • 152032-94-5

Reference: [1]European Journal of Medicinal Chemistry,1993,vol. 28,p. 499 - 504

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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