Cas no 342893-07-6 (Ethyl 3-(4-aminocyclohexyl)propanoate)
342893-07-6 structure
Product Name:Ethyl 3-(4-aminocyclohexyl)propanoate
CAS No:342893-07-6
MF:C11H21NO2
MW:199.28994345665
CID:2136417
Update Time:2023-08-04
Ethyl 3-(4-aminocyclohexyl)propanoate Chemical and Physical Properties
Names and Identifiers
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- ethyl 3-(4-aminocyclohexyl)propanoate
- Ethyl 3-(4-aminocyclohexyl)propanoate
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- Inchi： 1S/C11H21NO2/c1-2-14-11(13)8-5-9-3-6-10(12)7-4-9/h9-10H,2-8,12H2,1H3
- InChI Key： GXDMACATIQSXAV-UHFFFAOYSA-N
- SMILES： O(CC)C(CCC1CCC(CC1)N)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 174
- Topological Polar Surface Area: 52.3
Ethyl 3-(4-aminocyclohexyl)propanoate Related Literature
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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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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