Cas no 3211-87-8 (Bicyclo[2.2.1]heptane-2-carbonitrile,(1R,2S,4S)-rel-)
![Bicyclo[2.2.1]heptane-2-carbonitrile,(1R,2S,4S)-rel- structure](https://ossimg.kuujia.com/scimg/3500/3211-87-8x500.png)
3211-87-8 structure
Product Name:Bicyclo[2.2.1]heptane-2-carbonitrile,(1R,2S,4S)-rel-
Bicyclo[2.2.1]heptane-2-carbonitrile,(1R,2S,4S)-rel- Chemical and Physical Properties
Names and Identifiers
-
- Bicyclo[2.2.1]heptane-2-carbonitrile,(1R,2S,4S)-rel-
- endo-2-Cyanobicyclo[2.2.1]heptane
- (+-)-Norbornan-2endo-carbonitril
- (+-)-norbornane-2endo-carbonitrile
- 2-endo-norbornane carbonitrile
- 2-Nonyne-1,4-diol
- ACMC-20m27b
- AGN-PC-0022VQ
- CTK3F1570
- endo-2-Cyan-bicyclo< 2,2,1> heptan
- endo-2-Cyanonorbornan
- endo-2-Norbornylnitril
- NSC-46412
- SCHEMBL14448195
- Bicyclo[2.2.1]heptane-2-carbonitrile, endo-
- 3211-87-8
- NSC46412
-
- Inchi： 1S/C8H11N/c9-5-8-4-6-1-2-7(8)3-6/h6-8H,1-4H2/t6?,7?,8-/m0/s1
- InChI Key： GAHKEUUHTHVKEA-RRQHEKLDSA-N
- SMILES： N#C[C@@H]1CC2CCC1C2
Computed Properties
- Exact Mass: 121.08923
- Monoisotopic Mass: 121.089
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 165
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2
- Topological Polar Surface Area: 23.8?2
Experimental Properties
- Density: 1.01
- Boiling Point: 192.4°Cat760mmHg
- Flash Point: 78.9°C
- Refractive Index: 1.497
- PSA: 23.79
- LogP: 1.94618
Bicyclo[2.2.1]heptane-2-carbonitrile,(1R,2S,4S)-rel- Related Literature
-
Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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4. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
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