CAS
13578-25-1 Purity
96%
13578-25-1 Purity
96%
Shopping basket
1H-1,2,4-Triazole,1-[(4-methylphenyl)sulfonyl]-
CAS
13578-51-3
Catalog Number
ACM13578513
Category
Other Products
Molecular Weight
223.25
Molecular Formula
C9H9 N3 O2 S
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- Product Description
- Case Study
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- Synthetic Use
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Specification
Synonyms
1-(4-METHYLPHENYLSULFONYL)-1,2,4-TRIAZOLE;1-(p-Toluenesulfonyl)-1,2,4-triazole
IUPAC Name
1-(4-methylphenyl)sulfonyl-1,2,4-triazole
Canonical SMILES
CC1=CC=C(C=C1)S(=O)(=O)N2C=NC=N2
InChI Key
GFWABQNSSIQCLB-UHFFFAOYSA-N
Boiling Point
417.2ºC at 760mmHg
Flash Point
206.1ºC
Density
1.39g/cm³
Exact Mass
223.04200
H-Bond Acceptor
4
H-Bond Donor
0
Upstream Synthesis Route 1
- 288-88-0
- 98-59-9
- 13578-51-3
Reference: [1] Carbohydrate Research, 2003, vol. 338, # 5, p. 451 - 453
[2] Journal of Organic Chemistry, 2010, vol. 75, # 8, p. 2722 - 2725
[3] Patent: US2008/76933, 2008, A1, . Location in patent: Page/Page column 3-5
[4] Patent: EP1258480, 2002, A1, . Location in patent: Page 37
[5] Journal of Chemical Research, 2016, vol. 40, # 2, p. 101 - 106
Upstream Synthesis Route 2
- 288-88-0
- 824-79-3
- 13578-51-3
Reference: [1] Tetrahedron, 2017, vol. 73, # 17, p. 2504 - 2511
Upstream Synthesis Route 3
- 288-88-0
- 1576-35-8
- 13578-51-3
Reference: [1] Organic and Biomolecular Chemistry, 2015, vol. 14, # 2, p. 590 - 597
Upstream Synthesis Route 4
- 18293-54-4
- 98-59-9
- 75-77-4
- 13578-51-3
Reference: [1]Phosphorus and Sulfur and the Related Elements,1986,vol. 26,p. 321 - 326
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