Cas no 16503-26-7 (Bicyclo[2.2.1]heptane-2-ethanol,3,3-dimethyl-, (1R,2S,4S)-rel-)
![Bicyclo[2.2.1]heptane-2-ethanol,3,3-dimethyl-, (1R,2S,4S)-rel- structure](https://ossimg.kuujia.com/scimg/17000/16503-26-7x500.png)
16503-26-7 structure
Product Name:Bicyclo[2.2.1]heptane-2-ethanol,3,3-dimethyl-, (1R,2S,4S)-rel-
Bicyclo[2.2.1]heptane-2-ethanol,3,3-dimethyl-, (1R,2S,4S)-rel- Chemical and Physical Properties
Names and Identifiers
-
- Bicyclo[2.2.1]heptane-2-ethanol,3,3-dimethyl-, (1R,2S,4S)-rel-
- exo-3,3-Dimethylbicyclo(2.2.1)heptan-2-ethanol
- 2-methylpropyl methanesulfonate
- exo-3,3-dimethylbicyclo[2.2.1]heptan-2-ethanol
- Einecs 240-567-3
- EINECS 218-756-7
- 2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol
- NS00049519
- endo-2-(3,3-Dimethylbicyclo(2.2.1)hept-2-yl)ethanol
- 2226-08-6
- EINECS 240-472-7
- SCHEMBL10785695
- 2-(3,3-Dimethyl-bicyclo[2.2.1.]hept-2-yl)-ethanol
- 16503-26-7
- 2-(3,3-Dimethylbicyclo(2.2.1)hept-2-yl)ethanol
- 2-(3,3-Dimethylbicyclo[2.2.1]heptan-2-yl)ethan-1-ol
- DTXSID50936926
- 16423-26-0
- 2-(6,6-Dimethyl-5-bicyclo[2.2.1]heptanyl)ethanol
- Endo-2-[3,3-dimethylbicyclo[2.2.1]hept-2-yl]ethanol
-
- Inchi： 1S/C11H20O/c1-11(2)9-4-3-8(7-9)10(11)5-6-12/h8-10,12H,3-7H2,1-2H3
- InChI Key： DUINBOMGEZFPDK-UHFFFAOYSA-N
- SMILES： OCCC1C2CCC(C2)C1(C)C
Computed Properties
- Exact Mass: 168.1515
- Monoisotopic Mass: 168.151415
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 174
- 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
- Topological Polar Surface Area: 20.2
- XLogP3: 3
Experimental Properties
- Density: 0.941
- Boiling Point: 234.5°Cat760mmHg
- Flash Point: 103.8°C
- PSA: 20.23
Bicyclo[2.2.1]heptane-2-ethanol,3,3-dimethyl-, (1R,2S,4S)-rel- Related Literature
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1. Estimation of hydrogen sulfide from crude petroleum: a unique invention using a simple chemosensor?Shampa Kundu,Prithidipa Sahoo New J. Chem., 2019,43, 12369-12374
-
Vitaly Gurylev,Chung-Yi Su,Tsong-Pyng Perng Phys. Chem. Chem. Phys., 2016,18, 16033-16038
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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