Cas no 51720-68-4 (Formamide, N-[2-(1H-imidazol-4-yl)ethyl]-)
51720-68-4 structure
Product Name:Formamide, N-[2-(1H-imidazol-4-yl)ethyl]-
CAS No:51720-68-4
MF:C6H9N3O
MW:139.155160665512
CID:361590
PubChem ID:23223135
Update Time:2025-04-19
Formamide, N-[2-(1H-imidazol-4-yl)ethyl]- Chemical and Physical Properties
Names and Identifiers
-
- Formamide, N-[2-(1H-imidazol-4-yl)ethyl]-
- N-[2-(1H-imidazol-5-yl)ethyl]formamide
- AKOS006358686
- SCHEMBL1998467
- DTXSID10631304
- 51720-68-4
- N-(2-(1H-Imidazol-4-yl)ethyl)formamide
- AKOS013534087
- histamine-formaldehyde
-
- Inchi: 1S/C6H9N3O/c10-5-7-2-1-6-3-8-4-9-6/h3-5H,1-2H2,(H,7,10)(H,8,9)
- InChI Key: ASVICRPYPUCQCT-UHFFFAOYSA-N
- SMILES: O=CNCCC1=CN=CN1
Computed Properties
- Exact Mass: 139.07467
- Monoisotopic Mass: 139.074561919g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 107
- 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: -0.4
- Topological Polar Surface Area: 57.8?2
Experimental Properties
- PSA: 57.78
Formamide, N-[2-(1H-imidazol-4-yl)ethyl]- Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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