Cas no 139669-61-7 (2-Pyrrolidinone, 3-ethyl-4-(phenylmethyl)-, trans-)
139669-61-7 structure
Product Name:2-Pyrrolidinone, 3-ethyl-4-(phenylmethyl)-, trans-
CAS No:139669-61-7
MF:C13H17NO
MW:203.280183553696
CID:1289613
Update Time:2024-08-03
2-Pyrrolidinone, 3-ethyl-4-(phenylmethyl)-, trans- Chemical and Physical Properties
Names and Identifiers
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- 2-Pyrrolidinone, 3-ethyl-4-(phenylmethyl)-, trans-
- 2-Pyrrolidinone, 3-ethyl-4-(phenylmethyl)-, (3R,4R)-rel-
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- Inchi： 1S/C13H17NO/c1-2-12-11(9-14-13(12)15)8-10-6-4-3-5-7-10/h3-7,11-12H,2,8-9H2,1H3,(H,14,15)/t11-,12+/m0/s1
- InChI Key： OGJZQBJYXFCVOG-NWDGAFQWSA-N
- SMILES： N1C[C@H](CC2=CC=CC=C2)[C@@H](CC)C1=O
Computed Properties
- Exact Mass: 203.13111
Experimental Properties
- Density: 1.031±0.06 g/cm3(Predicted)
- Boiling Point: 374.1±11.0 °C(Predicted)
- PSA: 29.1
- pka: 16.66±0.60(Predicted)
2-Pyrrolidinone, 3-ethyl-4-(phenylmethyl)-, trans- Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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