Cas no 478016-07-8 (1-(3-ethylisoxazol-5-yl)-N,N-dimethylmethanamine)
478016-07-8 structure
Product Name:1-(3-ethylisoxazol-5-yl)-N,N-dimethylmethanamine
CAS No:478016-07-8
MF:C8H14N2O
MW:154.209561824799
CID:931408
PubChem ID:15530984
Update Time:2025-04-19
1-(3-ethylisoxazol-5-yl)-N,N-dimethylmethanamine Chemical and Physical Properties
Names and Identifiers
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- 5-Isoxazolemethanamine,3-ethyl-N,N-dimethyl-(9CI)
- 478016-07-8
- 1-(3-ethylisoxazol-5-yl)-N,N-dimethylmethanamine
-
- Inchi： 1S/C8H14N2O/c1-4-7-5-8(11-9-7)6-10(2)3/h5H,4,6H2,1-3H3
- InChI Key： HFXSPXALFUUTHQ-UHFFFAOYSA-N
- SMILES： O1C(=CC(CC)=N1)CN(C)C
Computed Properties
- Exact Mass: 154.110613074g/mol
- Monoisotopic Mass: 154.110613074g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 117
- 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: 1.1
- Topological Polar Surface Area: 29.3?2
1-(3-ethylisoxazol-5-yl)-N,N-dimethylmethanamine Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Masrudin Md Yusoff,Muggundha Raoov,Noorfatimah Yahaya,Noorashikin Md Salleh RSC Adv., 2017,7, 35832-35844
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