Cas no 2582-31-2 (2,5-Cyclohexadien-1-one, 4-[(4-hydroxy-2-methylphenyl)imino]-)
![2,5-Cyclohexadien-1-one, 4-[(4-hydroxy-2-methylphenyl)imino]- structure](https://ossimg.kuujia.com/scimg/3000/2582-31-2x500.png)
2582-31-2 structure
Product Name:2,5-Cyclohexadien-1-one, 4-[(4-hydroxy-2-methylphenyl)imino]-
CAS No:2582-31-2
MF:C13H11NO2
MW:213.231943368912
CID:237808
PubChem ID:407906
Update Time:2025-04-19
2,5-Cyclohexadien-1-one, 4-[(4-hydroxy-2-methylphenyl)imino]- Chemical and Physical Properties
Names and Identifiers
-
- 2,5-Cyclohexadien-1-one, 4-[(4-hydroxy-2-methylphenyl)imino]-
- 4-(4-hydroxyphenyl)imino-3-methylcyclohexa-2,5-dien-1-one
- DTXSID90328205
- 2582-31-2
-
- Inchi： 1S/C13H11NO2/c1-9-8-12(16)6-7-13(9)14-10-2-4-11(15)5-3-10/h2-8,15H,1H3/b14-13+
- InChI Key： WXFJPCOSLKBFDW-BUHFOSPRSA-N
- SMILES： OC1C=CC(=CC=1)/N=C1\C=CC(C=C\1C)=O
Computed Properties
- Exact Mass: 213.078978594g/mol
- Monoisotopic Mass: 213.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 371
- 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: 1.9
- Topological Polar Surface Area: 49.7?2
2,5-Cyclohexadien-1-one, 4-[(4-hydroxy-2-methylphenyl)imino]- Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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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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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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