Cas no 89656-82-6 (Cyclohexanecarboxylic acid, 1-methyl-2-oxo-, methyl ester, (1R)-)
89656-82-6 structure
Product Name:Cyclohexanecarboxylic acid, 1-methyl-2-oxo-, methyl ester, (1R)-
CAS No:89656-82-6
MF:C9H14O3
MW:170.205663204193
CID:593180
PubChem ID:12418821
Update Time:2025-04-19
Cyclohexanecarboxylic acid, 1-methyl-2-oxo-, methyl ester, (1R)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanecarboxylic acid, 1-methyl-2-oxo-, methyl ester, (1R)-
- 89656-82-6
- SCHEMBL7550154
- METHYL (R)-1-METHYL-2-OXOCYCLOHEXANE-1-CARBOXYLATE
- AT36583
-
- Inchi： 1S/C9H14O3/c1-9(8(11)12-2)6-4-3-5-7(9)10/h3-6H2,1-2H3/t9-/m1/s1
- InChI Key： XVOWMIBAOJEFIT-SECBINFHSA-N
- SMILES： O=C1CCCC[C@]1(C(=O)OC)C
Computed Properties
- Exact Mass: 170.094294304g/mol
- Monoisotopic Mass: 170.094294304g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 210
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.4
- Topological Polar Surface Area: 43.4?2
Cyclohexanecarboxylic acid, 1-methyl-2-oxo-, methyl ester, (1R)- Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
89656-82-6 (Cyclohexanecarboxylic acid, 1-methyl-2-oxo-, methyl ester, (1R)-) Related Products
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- 1655-07-8(ethyl 2-oxocyclohexane-1-carboxylate)
- 51756-08-2(methyl 2-ethylacetoacetate)
- 10472-24-9(methyl 2-oxocyclopentane-1-carboxylate)
- 42558-54-3(Methyl 4-methyl-3-oxopentanoate)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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