Cas no 19038-34-7 (Butanoic acid, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, endo-)
![Butanoic acid, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, endo- structure](https://ossimg.kuujia.com/scimg/19500/19038-34-7x500.png)
19038-34-7 structure
Product Name:Butanoic acid, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, endo-
CAS No:19038-34-7
MF:C12H21NO2
MW:211.30064368248
CID:1383568
PubChem ID:101415904
Update Time:2025-04-20
Butanoic acid, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, endo- Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, endo-
- 19038-34-7
- 3-Butyryloxytropane
-
- Inchi： 1S/C12H21NO2/c1-3-4-12(14)15-11-7-9-5-6-10(8-11)13(9)2/h9-11H,3-8H2,1-2H3
- InChI Key： NGOWJAIPSPMOOJ-UHFFFAOYSA-N
- SMILES： O(C(CCC)=O)C1CC2CCC(C1)N2C
Computed Properties
- Exact Mass: 453.15554
- Monoisotopic Mass: 211.157228913g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 228
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.2
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- Color/Form: Oil
- PSA: 113.37
Butanoic acid, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, endo- Related Literature
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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