Cas no 99187-39-0 (Phenol, 4-(4-bromobutyl)-)
Phenol, 4-(4-bromobutyl)- structure
Product Name:Phenol, 4-(4-bromobutyl)-
CAS No:99187-39-0
MF:C10H13BrO
MW:229.113622426987
CID:750331
PubChem ID:11128076
Update Time:2025-04-19
Phenol, 4-(4-bromobutyl)- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 4-(4-bromobutyl)-
- 4-(4-bromobutyl)phenol
- AKOS018657813
- 99187-39-0
- SOKVQCYEDUGTEI-UHFFFAOYSA-N
- SCHEMBL6964959
- 4-(4-hydroxyphenyl)butyl bromide
- DTXSID10456236
- 4-(4'-bromobutyl)phenol
-
- Inchi： 1S/C10H13BrO/c11-8-2-1-3-9-4-6-10(12)7-5-9/h4-7,12H,1-3,8H2
- InChI Key： SOKVQCYEDUGTEI-UHFFFAOYSA-N
- SMILES： BrCCCCC1C=CC(=CC=1)O
Computed Properties
- Exact Mass: 228.01498g/mol
- Monoisotopic Mass: 228.01498g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 108
- 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: 3.3
- Topological Polar Surface Area: 20.2?2
Phenol, 4-(4-bromobutyl)- Related Literature
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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