Cas no 51307-45-0 (1-Butanone,4-(diethylamino)-1-(10H-phenothiazin-10-yl)-)
51307-45-0 structure
Product Name:1-Butanone,4-(diethylamino)-1-(10H-phenothiazin-10-yl)-
CAS No:51307-45-0
MF:C20H24N2OS
MW:340.482363700867
CID:384192
PubChem ID:142838
Update Time:2025-04-19
1-Butanone,4-(diethylamino)-1-(10H-phenothiazin-10-yl)- Chemical and Physical Properties
Names and Identifiers
-
- 1-Butanone,4-(diethylamino)-1-(10H-phenothiazin-10-yl)-
- 10H-Phenothiazine, 10-(4-(diethylamino)-1-oxobutyl)-
- 4-(diethylamino)-1-phenothiazin-10-ylbutan-1-one
- DTXSID30199310
- 51307-45-0
- 10H-Phenothiazine,10-[4-(diethylamino)-1-oxobutyl]-
-
- Inchi： 1S/C20H24N2OS/c1-3-21(4-2)15-9-14-20(23)22-16-10-5-7-12-18(16)24-19-13-8-6-11-17(19)22/h5-8,10-13H,3-4,9,14-15H2,1-2H3
- InChI Key： BRRXOKBGUOVQMT-UHFFFAOYSA-N
- SMILES： S1C2C=CC=CC=2N(C2C=CC=CC1=2)C(CCCN(CC)CC)=O
Computed Properties
- Exact Mass: 340.16112
- Monoisotopic Mass: 340.160934
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 24
- Rotatable Bond Count: 6
- Complexity: 390
- 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
- Topological Polar Surface Area: 48.8
- XLogP3: 4
Experimental Properties
- Density: 1.157
- Boiling Point: 531.8°Cat760mmHg
- Flash Point: 275.4°C
- Refractive Index: 1.607
- PSA: 23.55
1-Butanone,4-(diethylamino)-1-(10H-phenothiazin-10-yl)- Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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