Cas no 20914-92-5 (Ethyl 3-ethoxypropanimidate;hydrochloride)
20914-92-5 structure
Product Name:Ethyl 3-ethoxypropanimidate;hydrochloride
CAS No:20914-92-5
MF:C7H16ClNO2
MW:181.660441398621
CID:910767
PubChem ID:24199662
Update Time:2025-04-19
Ethyl 3-ethoxypropanimidate;hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- ethyl 3-ethoxypropanimidate,hydrochloride
- Ethyl 3-ethoxypropanimidate
- hydrochloride
- 20914-92-5
- NSC-338575
- NSC338575
- DTXSID00639314
- SCHEMBL11604566
- Ethyl 3-ethoxypropanimidate hydrochloride
- Ethyl 3-ethoxypropanimidate--hydrogen chloride (1/1)
- Ethyl 3-ethoxypropanimidate;hydrochloride
-
- Inchi： 1S/C7H15NO2.ClH/c1-3-9-6-5-7(8)10-4-2;/h8H,3-6H2,1-2H3;1H
- InChI Key： VGRIRHYTUUHCCP-UHFFFAOYSA-N
- SMILES： Cl.O(CC)CCC(=N)OCC
Computed Properties
- Exact Mass: 145.11035
- Monoisotopic Mass: 181.0869564g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 93.6
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 42.3?2
Experimental Properties
- PSA: 42.31
Ethyl 3-ethoxypropanimidate;hydrochloride Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
-
Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
-
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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