CAS
3581-01-9 Purity
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3581-01-9 Purity
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N-Bromosaccharin
CAS
35812-01-2
Catalog Number
ACM35812012
Category
Other Products
Molecular Weight
262.08
Molecular Formula
C7H4BrNO3S
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Specification
Synonyms
N-Bromosaccharin, CID64791, EINECS 252-737-4, ZINC02020481, B2152, 2-Bromo-1,2-benzisothiazol-3(2H)-one 1,1-dioxide, 35812-01-2
IUPAC Name
2-bromo-1,1-dioxo-1,2-benzothiazol-3-one
SMILES
C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)Br
InChI Key
QRADPXNAURXMSB-UHFFFAOYSA-N
Boiling Point
404.4ºC at 760mmHg
Melting Point
160ºC
Flash Point
198.3ºC
Density
2.063g/cm³
EC Number
252-737-4
Exact Mass
260.91000
H-Bond Acceptor
3
H-Bond Donor
0
Safety Description
26-36/37/39
Upstream Synthesis Route 1
- 128-44-9
- 35812-01-2
Reference: [1]Wang, Qiang; Qi, Zisong; Xie, Fang; Li, Xingwei
[Advanced Synthesis and Catalysis, 2015, vol. 357, # 2-3, p. 355 - 360]
[2]De Souza, Soraia P. L.; Da Silva, Joaquim F. M.; De Mattos, Marcio C. S.
[Synthetic Communications, 2003, vol. 33, # 6, p. 935 - 939]
[3]Manoharan, V.; Venkatasubramanian, N.
[Journal of the Indian Chemical Society, 1986, vol. 63, p. 613 - 615]
Upstream Synthesis Route 2
- 81-07-2
- 35812-01-2
Reference: [1]Current Patent Assignee: TECHNION ISRAEL INSTITUTE OF TECHNOLOGY - WO2017/60905, 2017, A1
Location in patent: Paragraph 00113; 00115
Downstream Synthesis Route 1
- 35812-01-2
- 766-97-2
- 1561176-80-4
Reference: [1]Li, Mengru; Yuan, Haiyan; Zhao, Baozhong; Liang, Fushun; Zhang, Jingping
[Chemical Communications, 2014, vol. 50, # 18, p. 2360 - 2363]
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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