Cas no 5486-02-2 ((6Z)-6-{[(2-hydroxy-4-methylphenyl)amino]methylidene}-2-methylcyclohexa-2,4-dien-1-one)
![(6Z)-6-{[(2-hydroxy-4-methylphenyl)amino]methylidene}-2-methylcyclohexa-2,4-dien-1-one structure](https://ossimg.kuujia.com/scimg/5500/5486-02-2x500.png)
5486-02-2 structure
Product Name:(6Z)-6-{[(2-hydroxy-4-methylphenyl)amino]methylidene}-2-methylcyclohexa-2,4-dien-1-one
CAS No:5486-02-2
MF:C15H15NO2
MW:241.285104036331
CID:1593727
PubChem ID:870550
Update Time:2025-04-21
(6Z)-6-{[(2-hydroxy-4-methylphenyl)amino]methylidene}-2-methylcyclohexa-2,4-dien-1-one Chemical and Physical Properties
Names and Identifiers
-
- (6Z)-6-{[(2-hydroxy-4-methylphenyl)amino]methylidene}-2-methylcyclohexa-2,4-dien-1-one
- Oprea1_236880
- CCG-9345
- 5486-02-2
- AC1NSUJ9
- DTXSID70416871
- SR-01000210736-1
- BIM-0022260.P001
- CBMicro_022141
- SR-01000210736
-
- Inchi： 1S/C15H15NO2/c1-10-6-7-13(14(17)8-10)16-9-12-5-3-4-11(2)15(12)18/h3-9,17-18H,1-2H3/b16-9+
- InChI Key： CTRQLOHPPHJDMG-CXUHLZMHSA-N
- SMILES： OC1=C(C)C=CC=C1/C=N/C1C=CC(C)=CC=1O
Computed Properties
- Exact Mass: 241.11035
- Monoisotopic Mass: 241.11
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 420
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 49.3A^2
- XLogP3: 3.2
Experimental Properties
- Density: 1.291
- Boiling Point: 402.5°C at 760 mmHg
- Flash Point: 197.2°C
- Refractive Index: 1.72
- PSA: 49.33
(6Z)-6-{[(2-hydroxy-4-methylphenyl)amino]methylidene}-2-methylcyclohexa-2,4-dien-1-one Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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