Cas no 136902-57-3 (1,4,7,10-Tetraazacyclododecane,1,4,7-trimethyl-10-(1-oxo-2-propenyl)-)
136902-57-3 structure
Product Name:1,4,7,10-Tetraazacyclododecane,1,4,7-trimethyl-10-(1-oxo-2-propenyl)-
CAS No:136902-57-3
MF:C14H28N4O
MW:268.398323059082
CID:1242495
PubChem ID:165345340
Update Time:2025-04-20
1,4,7,10-Tetraazacyclododecane,1,4,7-trimethyl-10-(1-oxo-2-propenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,4,7,10-Tetraazacyclododecane,1,4,7-trimethyl-10-(1-oxo-2-propenyl)-
- 1-(4,7,10-Trimethyl-1,4,7,10-tetraazacyclododec-1-yl)-2-propen-1-one
- 136902-57-3
- DTXSID201160615
-
- Inchi： 1S/C14H28N4O/c1-5-14(19)18-12-10-16(3)8-6-15(2)7-9-17(4)11-13-18/h5H,1,6-13H2,2-4H3
- InChI Key： IVSCNQAPAOMODZ-UHFFFAOYSA-N
- SMILES： O=C(C=C)N1CCN(C)CCN(C)CCN(C)CC1
Computed Properties
- Exact Mass: 268.22654
- Monoisotopic Mass: 268.22631153g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 1
- Complexity: 277
- 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: 0.2
- Topological Polar Surface Area: 30?2
Experimental Properties
- PSA: 30.03
1,4,7,10-Tetraazacyclododecane,1,4,7-trimethyl-10-(1-oxo-2-propenyl)- Related Literature
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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