Cas no 86616-78-6 (2-Cyclohepten-1-one, 3-ethoxy-)
86616-78-6 structure
Product Name:2-Cyclohepten-1-one, 3-ethoxy-
CAS No:86616-78-6
MF:C9H14O2
MW:154.206263065338
CID:661140
PubChem ID:15670651
Update Time:2025-04-19
2-Cyclohepten-1-one, 3-ethoxy- Chemical and Physical Properties
Names and Identifiers
-
- 2-Cyclohepten-1-one, 3-ethoxy-
- 3-ethoxycyclohept-2-en-1-one
- 86616-78-6
- DTXSID90576648
- CVOGBHWKYXUUSC-UHFFFAOYSA-N
- SCHEMBL6515435
- 3-ethoxy-2-cycloheptenone
- 3-ethoxy-2-cyclohepten-1-one
- 3-ethoxycycloheptenone
-
- Inchi： 1S/C9H14O2/c1-2-11-9-6-4-3-5-8(10)7-9/h7H,2-6H2,1H3
- InChI Key： CVOGBHWKYXUUSC-UHFFFAOYSA-N
- SMILES： O(CC)C1=CC(CCCC1)=O
Computed Properties
- Exact Mass: 154.099379685g/mol
- Monoisotopic Mass: 154.099379685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 170
- 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: 1.3
- Topological Polar Surface Area: 26.3?2
2-Cyclohepten-1-one, 3-ethoxy- Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
86616-78-6 (2-Cyclohepten-1-one, 3-ethoxy-) Related Products
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- 16493-04-2(3-Butoxycyclohex-2-en-1-one)
- 4683-50-5(3-methoxycyclopent-2-en-1-one)
- 23074-59-1(3-Isobutoxy-2-cyclohexen-1-one)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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