Cas no 581092-53-7 (1-Benzyl-2-[(E)-3-(1-benzyl-1,3-dimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]-1,3-dimethylbenzo[e]indole;hexafluorophosphate)
![1-Benzyl-2-[(E)-3-(1-benzyl-1,3-dimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]-1,3-dimethylbenzo[e]indole;hexafluorophosphate structure](https://ossimg.kuujia.com/scimg/581500/581092-53-7x500.png)
581092-53-7 structure
Product Name:1-Benzyl-2-[(E)-3-(1-benzyl-1,3-dimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]-1,3-dimethylbenzo[e]indole;hexafluorophosphate
CAS No:581092-53-7
MF:C45H41F6N2P
MW:754.784633398056
MDL:MFCD18071595
CID:822594
PubChem ID:74891379
Update Time:2025-04-19
1-Benzyl-2-[(E)-3-(1-benzyl-1,3-dimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]-1,3-dimethylbenzo[e]indole;hexafluorophosphate Chemical and Physical Properties
Names and Identifiers
-
- 2-[3-[1,3-Dihydro-1,3-dimethyl-1-(phenylmethyl)-2H-benz[e]indol-2-ylidene]-1-propen-1-yl]-1,3-dimethyl-1-(phenylmethyl)-1H-benz[e]indolium
- IRG-022
- 1-BENZYL-2-[3-(1-BENZYL-1,3-DIMETHYL-1H-BENZO[E]INDOL-2(3H)-YLIDENE)-1-PROPEN-1-YL]-1,3-DIMETHYL-1H-BENZO[E]INDOL-3-IUM...
- 1H-?Benz[e]?indolium, 2-?[3-?[1,?3-?dihydro-?1,?3-?dimethyl-?1-?(phenylmethyl)?-?2H-?benz[e]?indol-?2-?ylidene]?-?1-?propen-?1-?yl]?-?1,?3-?dimethyl-?1-?(phenylmethyl)?-?, hexafluorophosphate(?1-?) (1
- DCY02
- 1-Benzyl-2-[3-(1-benzyl-1,3-dimethyl-1H-benzo[e]indol-2(3H)-ylidene)-1-propen-1-yl]-1,3-dimethyl-1H-benzo[e]indol-3-ium Hexafluorophosphate
- 1H-?Benz[e]?indolium, 2-?[3-?[1,?3-?dihydro-?1,?3-?dimethyl-?1-?(phenylmethyl)?-?2H-?benz[e]?indol-?2-?ylidene]?-?1-?propen-?1-?yl]?-?1,?3-?dimethyl-?1-?(phenylmethyl)?-?, hexafluorophosphate(?1-?)
- 2-[3-[1,3-Dihydro-1,3-dimethyl-1-(phenylmethyl)-2H-benz[e]indol-2-ylidene]-1-propenyl]-1,3-dimethyl-1-(phenylmethyl)-1H-benz[e]indolium hexafluorophosphate(1-)
- 1-Benzyl-2-[(E)-3-(1-benzyl-1,3-dimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]-1,3-dimethylbenzo
- MFCD26961168
- CS-0453867
- 581092-53-7
- 1-Benzyl-2-(3-(1-benzyl-1,3-dimethyl-1,3-dihydro-2H-benzo[e]indol-2-ylidene)prop-1-en-1-yl)-1,3-dimethyl-1H-benzo[e]indol-3-ium hexafluorophosphate(V)
- AKOS024438769
- 1-Benzyl-2-[3-(1-benzyl-1 pound not3-dimethyl-1H-benzo[e]indol-2(3H)-ylidene)-1-propen-1-yl]-1 pound not3-dimethyl-1H-benzo[e]indol-3-ium Hexafluorophosphate
- 2-[3-[1,3-Dihydro-1,3-dimethyl-1-(phenylmethyl)-2H-benz[e]indol-2-ylidene]-1-propen-1-yl]-1,3-dimethyl-1-(phenylmethyl)-1H-benz[e]indolium hexafluorophosphate(1-) (1
- 1-benzyl-2-[(1E)-3-[(2E)-1-benzyl-1,3-dimethyl-1H,2H,3H-benzo[e]indol-2-ylidene]prop-1-en-1-yl]-1,3-dimethyl-1H-benzo[e]indol-3-ium; hexafluoro-??-phosphanuide
- AS-75224
- 1-Benzyl-2-[(E)-3-(1-benzyl-1,3-dimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]-1,3-dimethylbenzo[e]indole;hexafluorophosphate
-
- MDL： MFCD18071595
- Inchi： 1S/C45H41N2.F6P/c1-44(30-32-16-7-5-8-17-32)40(46(3)38-28-26-34-20-11-13-22-36(34)42(38)44)24-15-25-41-45(2,31-33-18-9-6-10-19-33)43-37-23-14-12-21-35(37)27-29-39(43)47(41)4;1-7(2,3,4,5)6/h5-29H,30-31H2,1-4H3;/q+1;-1
- InChI Key： ZKQHYSZGBRQBRF-UHFFFAOYSA-N
- SMILES： [P-](F)(F)(F)(F)(F)F.[N+]1(C)C2C=CC3C=CC=CC=3C=2C(C)(CC2C=CC=CC=2)C=1/C=C/C=C1/C(C)(CC2C=CC=CC=2)C2C3C=CC=CC=3C=CC=2N/1C
Computed Properties
- Exact Mass: 754.29000
- Monoisotopic Mass: 754.291
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 54
- Rotatable Bond Count: 6
- Complexity: 1170
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 2
- Topological Polar Surface Area: 6.2
Experimental Properties
- Color/Form: No data avaiable
- Density: No data available
- Melting Point: No data available
- Boiling Point: No data available
- Flash Point: No data available
- PSA: 0.00000
- LogP: 0.00000
- Vapor Pressure: No data available
1-Benzyl-2-[(E)-3-(1-benzyl-1,3-dimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]-1,3-dimethylbenzo[e]indole;hexafluorophosphate Security Information
- Signal Word：warning
- Hazard Statement： H303+H313+H333
-
Warning Statement：
P264Thoroughly clean after treatment
P280Wear protective gloves/Wear protective clothing/Wear protective goggles/Wear a protective mask
P305If it enters the eyes
P351Rinse carefully with water for a few minutes
P338Remove the contact lens(If any)And easy to operate,Continue flushing
P337If eye irritation persists
P313Obtain medical advice/care - Safety Instruction： H303+H313+H333
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
1-Benzyl-2-[(E)-3-(1-benzyl-1,3-dimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]-1,3-dimethylbenzo[e]indole;hexafluorophosphate Pricemore >>
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1-Benzyl-2-[3-(1-benzyl-1,3-dimethyl-1H-benzo[e]indol-2(3H)-ylidene)-1-propen-1-yl]-1,3-dimethyl-1H-benzo[e]indol-3-ium Hexafluorophosphate |
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1-Benzyl-2-[(E)-3-(1-benzyl-1,3-dimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]-1,3-dimethylbenzo[e]indole;hexafluorophosphate Related Literature
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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