CAS
63142-56-3 Purity
96%
63142-56-3 Purity
96%
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THIANAPHTHENE-2-CARBOXAMIDE
CAS
6314-42-7
Catalog Number
ACM6314427
Category
Other Products
Molecular Weight
177.22
Molecular Formula
C9H7NOS
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Specification
Synonyms
1-Benzothiophene-2-carboxamide, Benzo(b)thiophene-2-carboxamide, Benzo[b]thiophene-2-carboxamide, NSC40286, ZINC00042562, ST020045, 6314-42-7
IUPAC Name
1-benzothiophene-2-carboxamide
SMILES
C1=CC=C2C(=C1)C=C(S2)C(=O)N
InChI Key
GYSCBCSGKXNZRH-UHFFFAOYSA-N
Boiling Point
411.5ºC at 760 mmHg
Melting Point
176-178ºC
Flash Point
202.6ºC
Density
1.345g/cm³
Exact Mass
177.02500
H-Bond Acceptor
1
H-Bond Donor
1
Safety Description
S22-S24/25
Upstream Synthesis Route 1
- 39827-11-7
- 6314-42-7
Reference: [1]Goettsch; Wiese
[Journal of the American Pharmaceutical Association (1912), 1958, vol. 47, p. 319,320]
[2]Chapleo, Christopher B.; Myers, Peter L.; Butler, Richard C. M.; Davis, John A.; Doxey, John C.; et al.
[Journal of Medicinal Chemistry, 1984, vol. 27, # 5, p. 570 - 576]
[3]Yu, Yongshi; Tazeem; Xu, Zhichao; Du, Liaoqi; Jin, Mengyu; Dong, Chune; Zhou, Hai-Bing; Wu, Shuwen
[MedChemComm, 2019, vol. 10, # 1, p. 89 - 100]
Downstream Synthesis Route 1
- 6314-42-7
- 6314-43-8
Reference: [1]Journal of the American Chemical Society,1952,vol. 74,p. 664
[2]MedChemComm,2019,vol. 10,p. 89 - 100
Downstream Synthesis Route 2
- 6314-42-7
- 55219-11-9
Reference: [1]Journal of Organic Chemistry,2019
[2]Journal of Organic Chemistry,2019,vol. 84,p. 6084 - 6093
[3]Organic Letters,2009,vol. 11,p. 2461 - 2464
[4]Chemical Communications,2009,p. 4883 - 4885
[5]Journal of Medicinal Chemistry,1984,vol. 27,p. 570 - 576
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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