Cas no 917981-35-2 (1,3-Propanedione, 1,3-bis[4-[bis(4-methylphenyl)amino]phenyl]-)
![1,3-Propanedione, 1,3-bis[4-[bis(4-methylphenyl)amino]phenyl]- structure](https://ossimg.kuujia.com/scimg/918000/917981-35-2x500.png)
917981-35-2 structure
Product Name:1,3-Propanedione, 1,3-bis[4-[bis(4-methylphenyl)amino]phenyl]-
CAS No:917981-35-2
MF:C43H38N2O2
MW:614.774031162262
CID:780404
PubChem ID:58789494
Update Time:2025-04-19
1,3-Propanedione, 1,3-bis[4-[bis(4-methylphenyl)amino]phenyl]- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Propanedione, 1,3-bis[4-[bis(4-methylphenyl)amino]phenyl]-
- 1,3-bis[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]propane-1,3-dione
- DTXSID00730097
- 1,3-Bis{4-[bis(4-methylphenyl)amino]phenyl}propane-1,3-dione
- SCHEMBL14186126
- 917981-35-2
-
- Inchi： 1S/C43H38N2O2/c1-30-5-17-36(18-6-30)44(37-19-7-31(2)8-20-37)40-25-13-34(14-26-40)42(46)29-43(47)35-15-27-41(28-16-35)45(38-21-9-32(3)10-22-38)39-23-11-33(4)12-24-39/h5-28H,29H2,1-4H3
- InChI Key： RYCPTJLNIWYSSL-UHFFFAOYSA-N
- SMILES： O=C(CC(C1C=CC(=CC=1)N(C1C=CC(C)=CC=1)C1C=CC(C)=CC=1)=O)C1C=CC(=CC=1)N(C1C=CC(C)=CC=1)C1C=CC(C)=CC=1
Computed Properties
- Exact Mass: 614.293328459g/mol
- Monoisotopic Mass: 614.293328459g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 47
- Rotatable Bond Count: 10
- Complexity: 842
- 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: 11.1
- Topological Polar Surface Area: 40.6?2
1,3-Propanedione, 1,3-bis[4-[bis(4-methylphenyl)amino]phenyl]- Related Literature
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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