Cas no 933747-71-8 (Ethyl-(3-methyl-isoxazol-5-ylmethyl)-amine)
933747-71-8 structure
Product Name:Ethyl-(3-methyl-isoxazol-5-ylmethyl)-amine
CAS No:933747-71-8
MF:C7H12N2O
MW:140.182981491089
CID:2154111
Update Time:2023-08-05
Ethyl-(3-methyl-isoxazol-5-ylmethyl)-amine Chemical and Physical Properties
Names and Identifiers
-
- ethyl-(3-methyl-isoxazol-5-ylmethyl)-amine
- LIEAHLWEOLPYNU-UHFFFAOYSA-N
- Ethyl-(3-methyl-isoxazol-5-ylmethyl)-amine
-
- Inchi: 1S/C7H12N2O/c1-3-8-5-7-4-6(2)9-10-7/h4,8H,3,5H2,1-2H3
- InChI Key: LIEAHLWEOLPYNU-UHFFFAOYSA-N
- SMILES: O1C(=CC(C)=N1)CNCC
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 97.6
- Topological Polar Surface Area: 38.1
Ethyl-(3-methyl-isoxazol-5-ylmethyl)-amine Related Literature
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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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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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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