Cas no 885267-10-7 (Benzene,1-bromo-3-[(4-fluorobutyl)thio]-)
![Benzene,1-bromo-3-[(4-fluorobutyl)thio]- structure](https://ossimg.kuujia.com/scimg/885500/885267-10-7x500.png)
885267-10-7 structure
Product Name:Benzene,1-bromo-3-[(4-fluorobutyl)thio]-
CAS No:885267-10-7
MF:C10H12BrFS
MW:263.169684410095
CID:710586
PubChem ID:17750096
Update Time:2025-04-19
Benzene,1-bromo-3-[(4-fluorobutyl)thio]- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1-bromo-3-[(4-fluorobutyl)thio]-
- 1-Bromo-3-(4-fluoro-butylsulfanyl)-benzene
- DTXSID30590247
- 1-BROMO-3-[(4-FLUOROBUTYL)SULFANYL]BENZENE
- 1-Bromo-3-(4-fluoro-butylsulfanyl)benzene
- 885267-10-7
-
- Inchi： 1S/C10H12BrFS/c11-9-4-3-5-10(8-9)13-7-2-1-6-12/h3-5,8H,1-2,6-7H2
- InChI Key： JOUZZVMTLDTFTJ-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC(=C1)SCCCCF
Computed Properties
- Exact Mass: 261.983
- Monoisotopic Mass: 261.983
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 5
- Complexity: 132
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 4.2
- Topological Polar Surface Area: 25.3A^2
Benzene,1-bromo-3-[(4-fluorobutyl)thio]- Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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