2-[(1E)-2-[(3E)-2-chloro-3-{2-[(2E)-1,3,3-trimethyl-1H,2H,3H-benzo[g]indol-2-ylidene]ethylidene}cyclohex-1-en-1-yl]ethenyl]-1,3,3-trimethyl-3H-benzo[g]indol-1-ium 4-methylbenzene-1-sulfonate
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Basic information
GHS | |
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Exact Mass | 754.29959 |
Smiles | CC1C=CC(S(=O)(=O)[O-])=CC=1.CN1C2C(=CC=C3C=2C=CC=C3)C(C)(C)/C/1=C\C=C1/CCCC(=C/1Cl)C=CC1C(C)(C)C2=CC=C3C(C=CC=C3)=C2[N+]=1C |t:40| |
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Canonical Smiles | CC1C=CC(=CC=1)S([O-])(=O)=O.CC1(C)C2=CC=C3C=CC=CC3=C2[N+](C)=C1C=CC1CCC/C(=C\C=C2\N(C)C3C(=CC=C4C=CC=CC4=3)C\2(C)C)/C=1Cl |t:30| |
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Physicochemical Propertie | |
Inchi | InChI=1S/C40H40ClN2.C7H8O3S/c1-39(2)32-22-18-26-12-7-9-16-30(26)37(32)42(5)34(39)24-20-28-14-11-15-29(36(28)41)21-25-35-40(3,4)33-23-19-27-13-8-10-17-31(27)38(33)43(35)6;1-6-2-4-7(5-3-6)11(8,9)10/h7-10,12-13,16-25H,11,14-15H2,1-6H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1 |
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Useage | |
InchiKey | RLNNNRUBFZNUNK-UHFFFAOYSA-M |
Vapor Pressure | |
Transport Condition | Normal |
Security information
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Storage Temp. | RT |
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