Cas no 264873-88-3 (2-Propenoic acid, 4-(hexyloxy)phenyl ester)
264873-88-3 structure
Product Name:2-Propenoic acid, 4-(hexyloxy)phenyl ester
CAS No:264873-88-3
MF:C15H20O3
MW:248.317504882813
CID:1430648
PubChem ID:71357716
Update Time:2025-04-20
2-Propenoic acid, 4-(hexyloxy)phenyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid, 4-(hexyloxy)phenyl ester
- (4-hexoxyphenyl) prop-2-enoate
- 264873-88-3
- DTXSID90781770
- 4-(HEXYLOXY)PHENYL PROP-2-ENOATE
-
- Inchi： 1S/C15H20O3/c1-3-5-6-7-12-17-13-8-10-14(11-9-13)18-15(16)4-2/h4,8-11H,2-3,5-7,12H2,1H3
- InChI Key： OEUNLFOAYDJLAD-UHFFFAOYSA-N
- SMILES： O(C1C=CC(=CC=1)OC(C=C)=O)CCCCCC
Computed Properties
- Exact Mass: 248.1413
- Monoisotopic Mass: 248.14124450g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 9
- Complexity: 242
- 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: 4.6
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
2-Propenoic acid, 4-(hexyloxy)phenyl ester Related Literature
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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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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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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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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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