Cas no 918638-45-6 (Benzenesulfonamide, 4-bromo-N-(4-hydroxybutyl)-3-methyl-)
918638-45-6 structure
Product Name:Benzenesulfonamide, 4-bromo-N-(4-hydroxybutyl)-3-methyl-
CAS No:918638-45-6
MF:C11H16BrNO3S
MW:322.218641281128
CID:772359
PubChem ID:16094724
Update Time:2025-04-19
Benzenesulfonamide, 4-bromo-N-(4-hydroxybutyl)-3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonamide, 4-bromo-N-(4-hydroxybutyl)-3-methyl-
- 4-bromo-N-(4-hydroxybutyl)-3-methylbenzenesulfonamide
- SCHEMBL2011855
- GBYWHYGZEVZVES-UHFFFAOYSA-N
- DTXSID70582444
- 4-Bromo-N-(4-hydroxybutyl)-3-methylbenzene-1-sulfonamide
- 4-Bromo-3-methylphenyl-sulfonic acid-(4-hydroxybutyl)-amide
- 918638-45-6
-
- Inchi： 1S/C11H16BrNO3S/c1-9-8-10(4-5-11(9)12)17(15,16)13-6-2-3-7-14/h4-5,8,13-14H,2-3,6-7H2,1H3
- InChI Key： GBYWHYGZEVZVES-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=CC=1C)S(NCCCCO)(=O)=O
Computed Properties
- Exact Mass: 321.00343g/mol
- Monoisotopic Mass: 321.00343g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 6
- Complexity: 315
- 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
- XLogP3: 2
- Topological Polar Surface Area: 74.8?2
Benzenesulfonamide, 4-bromo-N-(4-hydroxybutyl)-3-methyl- Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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