Cas no 834885-76-6 (Cyclopentanecarbonitrile, 1-hydroxy-2-methyl-, (1S,2S)-)
834885-76-6 structure
Product Name:Cyclopentanecarbonitrile, 1-hydroxy-2-methyl-, (1S,2S)-
CAS No:834885-76-6
MF:C7H11NO
MW:125.168341875076
CID:670699
PubChem ID:71415296
Update Time:2025-04-19
Cyclopentanecarbonitrile, 1-hydroxy-2-methyl-, (1S,2S)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclopentanecarbonitrile, 1-hydroxy-2-methyl-, (1S,2S)-
- (1S,2S)-1-Hydroxy-2-methylcyclopentane-1-carbonitrile
- 834885-76-6
- DTXSID50834716
-
- Inchi： 1S/C7H11NO/c1-6-3-2-4-7(6,9)5-8/h6,9H,2-4H2,1H3/t6-,7+/m0/s1
- InChI Key： YIBMTUNZXDLNOD-NKWVEPMBSA-N
- SMILES： O[C@@]1(C#N)CCC[C@@H]1C
Computed Properties
- Exact Mass: 125.084063974g/mol
- Monoisotopic Mass: 125.084063974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 158
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.8
- Topological Polar Surface Area: 44?2
Cyclopentanecarbonitrile, 1-hydroxy-2-methyl-, (1S,2S)- Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
834885-76-6 (Cyclopentanecarbonitrile, 1-hydroxy-2-methyl-, (1S,2S)-) Related Products
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