Cas no 93981-85-2 (Cyclooctenol, acetate(9CI))
Cyclooctenol, acetate(9CI) structure
Product Name:Cyclooctenol, acetate(9CI)
CAS No:93981-85-2
MF:C10H16O2
MW:168.232843399048
CID:810115
PubChem ID:6174495
Update Time:2025-04-19
Cyclooctenol, acetate(9CI) Chemical and Physical Properties
Names and Identifiers
-
- Cyclooctenol, acetate(9CI)
- cycloocten-1-yl acetate
- ACETIC ACID CYCLOOCT-1-ENYL ESTER
- EINECS 301-173-8
- SCHEMBL1695488
- 93981-85-2
- AKOS024323205
- CYCLOOCT-1-EN-1-YL ACETATE
- starbld0002649
- Cyclooctenyl acetate
-
- Inchi： 1S/C10H16O2/c1-9(11)12-10-7-5-3-2-4-6-8-10/h7H,2-6,8H2,1H3/b10-7+
- InChI Key： GCKRQQJBNDAYRT-JXMROGBWSA-N
- SMILES： O(C(C)=O)C1=CCCCCCC1 |t:4|
Computed Properties
- Exact Mass: 168.11503
- Monoisotopic Mass: 168.11503
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 182
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 26.3
- XLogP3: 2.8
Experimental Properties
- Density: 0.97
- Boiling Point: 256.6°Cat760mmHg
- Flash Point: 100.7°C
- Refractive Index: 1.468
Cyclooctenol, acetate(9CI) Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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