Cas no 77278-75-2 (1-Piperazinecarboxylicacid, 4-(2-propen-1-yl)-, 1,1-dimethylethyl ester)
77278-75-2 structure
Product Name:1-Piperazinecarboxylicacid, 4-(2-propen-1-yl)-, 1,1-dimethylethyl ester
CAS No:77278-75-2
MF:C12H22N2O2
MW:226.315283298492
CID:562489
PubChem ID:11276205
Update Time:2025-04-19
1-Piperazinecarboxylicacid, 4-(2-propen-1-yl)-, 1,1-dimethylethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1-Piperazinecarboxylicacid, 4-(2-propen-1-yl)-, 1,1-dimethylethyl ester
- 4-ALLYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
- tert-butyl 4-prop-2-enylpiperazine-1-carboxylate
- 1-Piperazinecarboxylicacid,4-(2-propenyl)-,1,1-dimethylethyl ester (9CI)
- AG-H-08867
- 1-Piperazinecarboxylicacid,4-(2-propen-1-yl)-,1,1-dimethylethyl ester
- AKOS017241220
- SCHEMBL7447764
- 1-(tert-Butoxycarbonyl)-4-allylpiperazine
- 77278-75-2
- DTXSID60460924
-
- Inchi： 1S/C12H22N2O2/c1-5-6-13-7-9-14(10-8-13)11(15)16-12(2,3)4/h5H,1,6-10H2,2-4H3
- InChI Key： PMOKFILPEDLZAP-UHFFFAOYSA-N
- SMILES： O(C(N1CCN(CC=C)CC1)=O)C(C)(C)C
Computed Properties
- Exact Mass: 226.16800
- Monoisotopic Mass: 226.168127949g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 250
- 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
- XLogP3: 1.6
- Topological Polar Surface Area: 32.8?2
Experimental Properties
- PSA: 32.78000
- LogP: 1.60090
1-Piperazinecarboxylicacid, 4-(2-propen-1-yl)-, 1,1-dimethylethyl ester Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
77278-75-2 (1-Piperazinecarboxylicacid, 4-(2-propen-1-yl)-, 1,1-dimethylethyl ester) Related Products
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