Cas no 85204-27-9 (Cyclohexanepropanoicacid, 3-phenylpropyl ester)
85204-27-9 structure
Product Name:Cyclohexanepropanoicacid, 3-phenylpropyl ester
CAS No:85204-27-9
MF:C18H26O2
MW:274.397845745087
CID:725190
PubChem ID:94919
Update Time:2025-04-19
Cyclohexanepropanoicacid, 3-phenylpropyl ester Chemical and Physical Properties
Names and Identifiers
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- Cyclohexanepropanoicacid, 3-phenylpropyl ester
- 3-phenylpropyl 3-cyclohexylpropanoate
- 3-phenylpropyl cyclohexanepropionate
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- Inchi： 1S/C18H26O2/c19-18(14-13-17-10-5-2-6-11-17)20-15-7-12-16-8-3-1-4-9-16/h1,3-4,8-9,17H,2,5-7,10-15H2
- InChI Key： VECOJECXTIMSPX-UHFFFAOYSA-N
- SMILES： O(CCCC1C=CC=CC=1)C(CCC1CCCCC1)=O
Computed Properties
- Exact Mass: 274.193280068g/mol
- Monoisotopic Mass: 274.193280068g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 8
- Complexity: 263
- 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: 5.5
- Topological Polar Surface Area: 26.3?2
Cyclohexanepropanoicacid, 3-phenylpropyl ester Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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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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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
85204-27-9 (Cyclohexanepropanoicacid, 3-phenylpropyl ester) Related Products
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- 140-26-1(Phenethyl isovalerate)
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- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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