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100012-45-1

Basic Information
CAS No.: 100012-45-1
Name: 3274U
Molecular Structure:
Molecular Structure of 100012-45-1 (3274U)
Formula: C41H33BCl2F4N2
Molecular Weight: 711.42
Synonyms: 6-Chloro-2-[2-(3-[(6-chloro-1-ethylbenz[c,d,]indole-2[1H]-ylidene)ethylidene]-2-phenyl-1-cyclopenten-1-yl)ethenyl]-1-ethylbenz[c,d]indolium tetrafluoroborate;Benz[cd]indolium,6-chloro-2-[2-[3-[(6- chloro-1-ethylbenz[cd]indol-2(1H)-ylidene)- ethylidene]-2-phenyl-1-cyclopenten-1-yl]- ethenyl]-1-ethyl-,tetrafluoroborate(1-);PK 3274;IR 1051;
EINECS: N/A
Density: N/A
Melting Point: 230 °C (dec.)(lit.)
Boiling Point: N/A
Flash Point: N/A
Solubility: N/A
Appearance: N/A
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36
Transport Information: N/A
PSA: 7.94000
LogP: 11.92960
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    3274U

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    3274U

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    factory?direct?sale Application:healing drugs

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    3274U

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    factory?direct?sale Application:Fine chemical intermediates, used as the main raw material for the synthesis of various pesticides, medicines, surfactants, polymer monomers, and antifungal agents

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Specification

This chemical is called 6-Chloro-2-[2-(3-[(6-chloro-1-ethylbenz[c,d,]indole-2[1H]-ylidene)ethylidene]-2-phenyl-1-cyclopenten-1-yl)ethenyl]-1-ethylbenz[c,d]indolium tetrafluoroborate. With the molecular formula of C41H33BCl2F4N2, its product categories are C; Stains and Dyes. The CAS registry number of this chemical is 100012-45-1. Additionally, it should be stored at 2-8°C.

Other characteristics of the 6-Chloro-2-[2-(3-[(6-chloro-1-ethylbenz[c,d,]indole-2[1H]-ylidene)ethylidene]-2-phenyl-1-cyclopenten-1-yl)ethenyl]-1-ethylbenz[c,d]indolium tetrafluoroborate can be summarised as followings: (1)#H bond acceptors: 2; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 6.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure: 
1.SMILES: F[B-](F)(F)F.Clc2ccc1\[N+](=C(/c3c1c2ccc3)\C=C\C8=C(/c4ccccc4)\C(=C\C=C7/c6cccc5c(Cl)ccc(c56)N7CC)CC8)CC
2.InChI: InChI=1/C41H33Cl2N2.BF4/c1-3-44-35(31-14-8-12-29-33(42)20-24-37(44)40(29)31)22-18-27-16-17-28(39(27)26-10-6-5-7-11-26)19-23-36-32-15-9-13-30-34(43)21-25-38(41(30)32)45(36)4-2;2-1(3,4)5/h5-15,18-25H,3-4,16-17H2,1-2H3;/q+1;-1
3.InChIKey: ARGQPGULWAESKB-UHFFFAOYAX