Cas no 2892-66-2 (Cyclobutaneethanol,3-(hydroxymethyl)-2,2-dimethyl-)
2892-66-2 structure
Product Name:Cyclobutaneethanol,3-(hydroxymethyl)-2,2-dimethyl-
Cyclobutaneethanol,3-(hydroxymethyl)-2,2-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Cyclobutaneethanol,3-(hydroxymethyl)-2,2-dimethyl-
- 2-[3-(hydroxymethyl)-2,2-dimethylcyclobutyl]ethanol
- 2-(3-Hydroxymethyl-2,2-dimethyl-cyclobutyl)-aethanol
- 2-(3-hydroxymethyl-2,2-dimethyl-cyclobutyl)-ethanol
- AC1L689O
- AC1Q7C71
- AG-K-95314
- AR-1D6785
- CTK4G2417
- NSC96742
- 2892-66-2
- NSC-96742
- SCHEMBL18723554
- DTXSID50294457
-
- Inchi： 1S/C9H18O2/c1-9(2)7(3-4-10)5-8(9)6-11/h7-8,10-11H,3-6H2,1-2H3
- InChI Key： HDAYUBJKGHNFPD-UHFFFAOYSA-N
- SMILES： OCC1CC(CCO)C1(C)C
Computed Properties
- Exact Mass: 158.13074
- Monoisotopic Mass: 158.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 132
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1
- Topological Polar Surface Area: 40.5?2
Experimental Properties
- PSA: 40.46
- LogP: 1.02340
Cyclobutaneethanol,3-(hydroxymethyl)-2,2-dimethyl- Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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