Cas no 648895-50-5 (2-Hexanone, 1-[bis(phenylmethyl)amino]-4-methyl-1-phenyl-)
![2-Hexanone, 1-[bis(phenylmethyl)amino]-4-methyl-1-phenyl- structure](https://ossimg.kuujia.com/scimg/649000/648895-50-5x500.png)
648895-50-5 structure
Product Name:2-Hexanone, 1-[bis(phenylmethyl)amino]-4-methyl-1-phenyl-
CAS No:648895-50-5
MF:C27H31NO
MW:385.541147470474
CID:413295
PubChem ID:71378157
Update Time:2025-04-19
2-Hexanone, 1-[bis(phenylmethyl)amino]-4-methyl-1-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Hexanone, 1-[bis(phenylmethyl)amino]-4-methyl-1-phenyl-
- 1-(dibenzylamino)-4-methyl-1-phenylhexan-2-one
- DTXSID50800779
- 648895-50-5
-
- Inchi： 1S/C27H31NO/c1-3-22(2)19-26(29)27(25-17-11-6-12-18-25)28(20-23-13-7-4-8-14-23)21-24-15-9-5-10-16-24/h4-18,22,27H,3,19-21H2,1-2H3
- InChI Key： SKXAATWZZXERFA-UHFFFAOYSA-N
- SMILES： O=C(CC(C)CC)C(C1C=CC=CC=1)N(CC1C=CC=CC=1)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 385.24073
- Monoisotopic Mass: 385.240564612g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 29
- Rotatable Bond Count: 10
- Complexity: 437
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 6.5
- Topological Polar Surface Area: 20.3?2
Experimental Properties
- PSA: 20.31
2-Hexanone, 1-[bis(phenylmethyl)amino]-4-methyl-1-phenyl- Related Literature
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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