Cas no 6946-48-1 (Cyclohexaneacetic acid, 1-hydroxy-, butyl ester)
6946-48-1 structure
Product Name:Cyclohexaneacetic acid, 1-hydroxy-, butyl ester
CAS No:6946-48-1
MF:C12H22O3
MW:214.301284313202
CID:530332
PubChem ID:245376
Update Time:2025-04-19
Cyclohexaneacetic acid, 1-hydroxy-, butyl ester Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexaneacetic acid, 1-hydroxy-, butyl ester
- butyl 2-(1-hydroxycyclohexyl)acetate
- 6946-48-1
- NSC-57325
- NSC57325
- DTXSID80288687
-
- Inchi： 1S/C12H22O3/c1-2-3-9-15-11(13)10-12(14)7-5-4-6-8-12/h14H,2-10H2,1H3
- InChI Key： RZHRDWRQAUGJTB-UHFFFAOYSA-N
- SMILES： OC1(CC(=O)OCCCC)CCCCC1
Computed Properties
- Exact Mass: 214.15696
- Monoisotopic Mass: 214.15689456g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 6
- Complexity: 195
- 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: 2.8
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 46.53
Cyclohexaneacetic acid, 1-hydroxy-, butyl ester Related Literature
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
-
Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
6946-48-1 (Cyclohexaneacetic acid, 1-hydroxy-, butyl ester) Related Products
- 674-26-0(D,L-Mevalonic Acid Lactone)
- 287111-36-8(2H-Pyran-2-one-2,3-13C2,tetrahydro-4-hydroxy-4-methyl- (9CI))
- 40309-42-0(Ethyl 3-hydroxy-4-methylpentanoate)
- 18267-36-2(Ethyl 3-hydroxy-3-methylbutanoate)
- 19115-49-2((R)-Mevalonolactone)
- 34695-32-4(3-Hydroxy-3-methylglutaric Anhydride)
- 3444-72-2(Ethyl 2-hydroxycyclohexanecarboxylate)
- 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)
Recommended suppliers
Yunnanjiuzhen
Gold Member
Audited Supplier
CN Supplier
Bulk
Jiangxi Boyang Pharmaceutical Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Hunan Well Medicine Synthesis Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
Shanghai Aoguang Biotechnology Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Shanghai Bent Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk