Cas no 61273-24-3 (Ethanediamide, N,N''-1,3-propanediylbis-)
61273-24-3 structure
Product Name:Ethanediamide, N,N''-1,3-propanediylbis-
CAS No:61273-24-3
MF:C7H12N4O4
MW:216.194581031799
CID:486256
PubChem ID:15820501
Update Time:2025-04-19
Ethanediamide, N,N''-1,3-propanediylbis- Chemical and Physical Properties
Names and Identifiers
-
- Ethanediamide, N,N''-1,3-propanediylbis-
- N'-[3-(oxamoylamino)propyl]oxamide
- SCHEMBL9765342
- N~1~,N~1'~-(Propane-1,3-diyl)diethanediamide
- 61273-24-3
- DTXSID50578603
- 1,3-propylenebis(oxamide)
-
- Inchi： 1S/C7H12N4O4/c8-4(12)6(14)10-2-1-3-11-7(15)5(9)13/h1-3H2,(H2,8,12)(H2,9,13)(H,10,14)(H,11,15)
- InChI Key： VDNLMOXCKVYTBN-UHFFFAOYSA-N
- SMILES： O=C(C(N)=O)NCCCNC(C(N)=O)=O
Computed Properties
- Exact Mass: 216.08596
- Monoisotopic Mass: 216.08585488g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 261
- 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: -2.2
- Topological Polar Surface Area: 144?2
Experimental Properties
- PSA: 144.38
Ethanediamide, N,N''-1,3-propanediylbis- Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
-
Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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