Cas no 877926-53-9 (Benzenehexanol, 4-bromo-)
Benzenehexanol, 4-bromo- structure
Product Name:Benzenehexanol, 4-bromo-
CAS No:877926-53-9
MF:C12H17BrO
MW:257.166783094406
CID:2810772
PubChem ID:66887347
Update Time:2025-04-21
Benzenehexanol, 4-bromo- Chemical and Physical Properties
Names and Identifiers
-
- 877926-53-9
- AKOS030584270
- DTXSID30735974
- Benzenehexanol, 4-bromo-
- SCHEMBL1044964
- 6-(4-BROMOPHENYL)HEXAN-1-OL
-
- Inchi： 1S/C12H17BrO/c13-12-8-6-11(7-9-12)5-3-1-2-4-10-14/h6-9,14H,1-5,10H2
- InChI Key： YSYLFPUWBJGPEH-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=CC=1)CCCCCCO
Computed Properties
- Exact Mass: 256.04628Da
- Monoisotopic Mass: 256.04628Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 6
- Complexity: 130
- 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: 4
- Topological Polar Surface Area: 20.2?2
Benzenehexanol, 4-bromo- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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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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