CAS
56046-99-2 Purity
96%
56046-99-2 Purity
96%
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2-(2-Benzothiazolyl)-6-methylphenol
CAS
56048-53-4
Catalog Number
ACM56048534
Category
Other Products
Molecular Weight
241.31
Molecular Formula
C14H11NOS
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- Product Description
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Specification
Synonyms
2-(2-Benzothiazolyl)-6-methylphenol;2-(2-Hydroxy-3-methylphenyl)benzothiazole
IUPAC Name
6-(3H-1,3-benzothiazol-2-ylidene)-2-methylcyclohexa-2,4-dien-1-one
SMILES
CC1=CC=CC(=C2NC3=CC=CC=C3S2)C1=O
InChI Key
VRAFTOXPPSEOHY-UHFFFAOYSA-N
Boiling Point
414.6ºC at 760 mmHg
Flash Point
204.6ºC
Density
1.295 g/cm³
Exact Mass
241.05600
H-Bond Acceptor
2
H-Bond Donor
1
Upstream Synthesis Route 1
- 83-40-9
- 137-07-5
- 56048-53-4
Reference: [1]Journal of the Chemical Society. Perkin transactions II,1984,p. 2111 - 2118
Upstream Synthesis Route 2
- 95-16-9
- 1443440-54-7
- 56048-53-4
Reference: [1]Wu, Qian; Chen, Ying; Yan, Dingyuan; Zhang, Muyue; Lu, Yi; Sun, Wei-Yin; Zhao, Jing
[Chemical Science, 2016, vol. 8, # 1, p. 169 - 173]
[2]Li, Bijin; Lan, Jingbo; Wu, Di; You, Jingsong
[Angewandte Chemie - International Edition, 2015, vol. 54, # 47, p. 14008 - 14012][Angew. Chem., 2016]
Downstream Synthesis Route 1
- 56048-53-4
- 100-97-0
- 1870867-26-7
Reference: [1]Kroetz, Thais; Dos Santos, Marinalva C.; Beal, Roiney; Zanotto, Gabriel Modernell; Santos, Fabiano S.; Giacomelli, Fernando Carlos; Gonçalves, Paulo F. B.; De Lima, Vânia R.; Dal-Bó, Alexandre G.; Rodembusch, Fabiano S.
[Photochemical and Photobiological Sciences, 2019, vol. 18, # 5, p. 1171 - 1184]
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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