Cas no 67979-39-9 (2,5-Cyclohexadien-1-one, 4-[(4-methoxyphenyl)imino]-)
![2,5-Cyclohexadien-1-one, 4-[(4-methoxyphenyl)imino]- structure](https://ossimg.kuujia.com/scimg/68000/67979-39-9x500.png)
67979-39-9 structure
Product Name:2,5-Cyclohexadien-1-one, 4-[(4-methoxyphenyl)imino]-
CAS No:67979-39-9
MF:C13H11NO2
MW:213.231943368912
CID:393866
PubChem ID:12612111
Update Time:2025-04-19
2,5-Cyclohexadien-1-one, 4-[(4-methoxyphenyl)imino]- Chemical and Physical Properties
Names and Identifiers
-
- 2,5-Cyclohexadien-1-one, 4-[(4-methoxyphenyl)imino]-
- 4-(4-methoxyphenyl)iminocyclohexa-2,5-dien-1-one
- 4-[(4-Methoxyphenyl)imino]cyclohexa-2,5-dien-1-one
- DTXSID50504341
- 67979-39-9
- N-(4-methoxyphenyl)-1,4-benzoquinone imine
-
- Inchi： 1S/C13H11NO2/c1-16-13-8-4-11(5-9-13)14-10-2-6-12(15)7-3-10/h2-9H,1H3
- InChI Key： ADBFXZPNKRLUIO-UHFFFAOYSA-N
- SMILES： O(C)C1C=CC(=CC=1)/N=C1/C=CC(C=C/1)=O
Computed Properties
- Exact Mass: 213.07903
- Monoisotopic Mass: 213.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 329
- 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: 1.6
- Topological Polar Surface Area: 38.7?2
Experimental Properties
- PSA: 38.66
2,5-Cyclohexadien-1-one, 4-[(4-methoxyphenyl)imino]- Related Literature
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
-
Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
-
R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
67979-39-9 (2,5-Cyclohexadien-1-one, 4-[(4-methoxyphenyl)imino]-) Related Products
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