Cas no 88100-27-0 (Propanediamide, 2-(ethylamino)-)
88100-27-0 structure
Product Name:Propanediamide, 2-(ethylamino)-
CAS No:88100-27-0
MF:C5H11N3O2
MW:145.159740686417
CID:645104
PubChem ID:21789173
Update Time:2025-04-19
Propanediamide, 2-(ethylamino)- Chemical and Physical Properties
Names and Identifiers
-
- Propanediamide, 2-(ethylamino)-
- 2-(ethylamino)propanediamide
- DTXSID00618043
- 88100-27-0
- AKOS006363755
-
- Inchi: 1S/C5H11N3O2/c1-2-8-3(4(6)9)5(7)10/h3,8H,2H2,1H3,(H2,6,9)(H2,7,10)
- InChI Key: WQFIXWLMWSZCAT-UHFFFAOYSA-N
- SMILES: O=C(C(C(N)=O)NCC)N
Computed Properties
- Exact Mass: 145.085126602g/mol
- Monoisotopic Mass: 145.085126602g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 132
- 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: -1.7
- Topological Polar Surface Area: 98.2?2
Propanediamide, 2-(ethylamino)- Related Literature
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Mengke Li,Xinyi Cai,Zhenyang Qiao,Wentao Xie,Liangying Wang,Nan Zheng,Shi-Jian Su Chem. Commun., 2019,55, 7215-7218
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
-
Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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