Cas no 26735-85-3 (2-Octen-2-ol, acetate)
2-Octen-2-ol, acetate structure
Product Name:2-Octen-2-ol, acetate
CAS No:26735-85-3
MF:C10H18O2
MW:170.248723506927
CID:1428416
PubChem ID:91433455
Update Time:2025-04-20
2-Octen-2-ol, acetate Chemical and Physical Properties
Names and Identifiers
-
- 2-Octen-2-ol, acetate
- 2-Octene-2-ol acetate
- 26735-85-3
-
- Inchi： 1S/C10H18O2/c1-4-5-6-7-8-9(2)12-10(3)11/h8H,4-7H2,1-3H3
- InChI Key： MHPJMRRHDSSIFQ-UHFFFAOYSA-N
- SMILES： O(C(C)=O)C(C)=CCCCCC
Computed Properties
- Exact Mass: 188.1413
- Monoisotopic Mass: 170.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 6
- Complexity: 159
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 3.3
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 57.53
2-Octen-2-ol, acetate Related Literature
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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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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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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