Cas no 282528-65-8 (3-Butoxy-1,2-dihydropyrrol-5-one)
282528-65-8 structure
Product Name:3-Butoxy-1,2-dihydropyrrol-5-one
CAS No:282528-65-8
MF:C8H13NO2
MW:155.194322347641
CID:248370
Update Time:2023-08-02
3-Butoxy-1,2-dihydropyrrol-5-one Chemical and Physical Properties
Names and Identifiers
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- 2H-Pyrrol-2-one,4-butoxy-1,5-dihydro-
- 2H-Pyrrol-2-one,4-butoxy-1,5-dihydro-(9CI)
- 4-n-butoxy-3-pyrrolin-2-one
- 3-Butoxy-1,2-dihydropyrrol-5-one
-
- Inchi： 1S/C8H13NO2/c1-2-3-4-11-7-5-8(10)9-6-7/h5H,2-4,6H2,1H3,(H,9,10)
- InChI Key： GRAFECHAVRXUHP-UHFFFAOYSA-N
- SMILES： O(C1=CC(NC1)=O)CCCC
Computed Properties
- Exact Mass: 155.095
- Monoisotopic Mass: 155.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 4
- Complexity: 175
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 38.3
3-Butoxy-1,2-dihydropyrrol-5-one Related Literature
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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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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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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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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