Cas no 33964-82-8 (Cyclohexanecarboxylicacid, 5-(1,1-dimethylethyl)-2-hydroxy-, (1a,2b,5a)- (9CI))
33964-82-8 structure
Product Name:Cyclohexanecarboxylicacid, 5-(1,1-dimethylethyl)-2-hydroxy-, (1a,2b,5a)- (9CI)
CAS No:33964-82-8
MF:C11H20O3
MW:200.274703979492
CID:308705
PubChem ID:118122
Update Time:2025-04-19
Cyclohexanecarboxylicacid, 5-(1,1-dimethylethyl)-2-hydroxy-, (1a,2b,5a)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Cyclohexanecarboxylicacid, 5-(1,1-dimethylethyl)-2-hydroxy-, (1a,2b,5a)- (9CI)
- 5-tert-butyl-2-hydroxycyclohexane-1-carboxylic acid
- (1alpha,2beta,5alpha)-5-(1,1-Dimethylethyl)-2-hydroxycyclohexanecarboxylic acid
- 5-tert-butyl-2-hydroxycyclohexanecarboxylic acid
- EINECS 251-764-9
- 5-tert-butyl-2-oxidanyl-cyclohexane-1-carboxylic acid
- A822586
- AKOS030239925
- DTXSID60955542
- 33964-82-8
- 5-tert-butyl-2-hydroxy-1-cyclohexanecarboxylic acid
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- Inchi： 1S/C11H20O3/c1-11(2,3)7-4-5-9(12)8(6-7)10(13)14/h7-9,12H,4-6H2,1-3H3,(H,13,14)
- InChI Key： PYEOMDZPPRSCOZ-UHFFFAOYSA-N
- SMILES： OC1CCC(CC1C(=O)O)C(C)(C)C
Computed Properties
- Exact Mass: 200.14124450g/mol
- Monoisotopic Mass: 200.14124450g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 217
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.5
- Topological Polar Surface Area: 57.5?2
Cyclohexanecarboxylicacid, 5-(1,1-dimethylethyl)-2-hydroxy-, (1a,2b,5a)- (9CI) Related Literature
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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