Cas no 62842-25-5 (Acetonitrile, (ethylmethylamino)-)
62842-25-5 structure
Product Name:Acetonitrile, (ethylmethylamino)-
CAS No:62842-25-5
MF:C5H10N2
MW:98.1463007926941
CID:1640932
PubChem ID:14799282
Update Time:2025-04-21
Acetonitrile, (ethylmethylamino)- Chemical and Physical Properties
Names and Identifiers
-
- Acetonitrile, (ethylmethylamino)-
- 2-[ethyl(methyl)amino]acetonitrile
- AKOS009415900
- [Ethyl(methyl)amino]acetonitrile
- 62842-25-5
- DTXSID10564188
-
- Inchi： 1S/C5H10N2/c1-3-7(2)5-4-6/h3,5H2,1-2H3
- InChI Key： PMVPEQSZVOKTAU-UHFFFAOYSA-N
- SMILES： N(C)(CC#N)CC
Computed Properties
- Exact Mass: 98.0845
- Monoisotopic Mass: 98.084398327g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 7
- Rotatable Bond Count: 2
- Complexity: 79.3
- 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: 27?2
Experimental Properties
- PSA: 27.03
Acetonitrile, (ethylmethylamino)- Related Literature
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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