Cas no 69629-20-5 (Cyclohexanone,3-[4-(2-hydroxyethyl)phenyl]-, oxime)
69629-20-5 structure
Product Name:Cyclohexanone,3-[4-(2-hydroxyethyl)phenyl]-, oxime
CAS No:69629-20-5
MF:C14H19NO2
MW:233.30616402626
CID:513323
PubChem ID:9588135
Update Time:2025-04-19
Cyclohexanone,3-[4-(2-hydroxyethyl)phenyl]-, oxime Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanone,3-[4-(2-hydroxyethyl)phenyl]-, oxime
- 2-[4-[(3E)-3-hydroxyiminocyclohexyl]phenyl]ethanol
- Cyclohexanone, 3-(4-(2-hydroxyethyl)phenyl)-, oxime
- 3-(4-(2-Hydroxyethyl)phenyl)cyclohexanone oxime
- 69629-20-5
- BRN 2980539
-
- Inchi: 1S/C14H19NO2/c16-9-8-11-4-6-12(7-5-11)13-2-1-3-14(10-13)15-17/h4-7,13,16-17H,1-3,8-10H2/b15-14+
- InChI Key: MUQWWDBPRFWFKI-CCEZHUSRSA-N
- SMILES: O/N=C1\CCCC(C2C=CC(CCO)=CC=2)C\1
Computed Properties
- Exact Mass: 233.14167
- Monoisotopic Mass: 233.141579
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 257
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 52.8
- XLogP3: 2.2
Experimental Properties
- Density: 1.165
- Boiling Point: 429.852°C at 760 mmHg
- Flash Point: 279.626°C
- Refractive Index: 1.581
- PSA: 52.82
Cyclohexanone,3-[4-(2-hydroxyethyl)phenyl]-, oxime Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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