- 3H-Indolium, 1,3,3-trimethyl-2-[2-(1-methyl-2-phenyl-1H-indol-3-yl)ethenyl]-, chloride (1:1)
- 3H-Indolium, 2-(2-(4-((2-chloroethyl)ethylamino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-, chloride (1:1)
- 3H-Indolium, 2-(2-(4-((2-cyanoethyl)methylamino)phenyl)ethenyl)-1,3,3-trimethyl-, phosphate (1:1)
- 3H-Indolium,1-ethyl-2,3,3-trimethyl-5-sulfo-, inner salt
- 3H-Indolium,2,3,3-trimethyl-1-(3-sulfopropyl)-, inner salt
- 146368-08-31-(5-carboxypentyl)-2,3,3-trimethyl-3H-indolium-5-sulfonate (IM OCS)
- 146368-09-43H-Indolium,1-ethyl-3,3-dimethyl-2-[2-(phenylamino)ethenyl]-5-sulfo-, inner salt
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- 146374-56-33(4H)-Quinazolineaceticacid, 5,6-dichloro-2-(cyanoamino)-, ethyl ester
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- 146381-87-52,4-Thiophenedicarboxylicacid, 5-[(2-chloroacetyl)amino]-3-methyl-, 2,4-diethyl ester
- 146386-55-2Tyrosine, hydrogensulfate (ester) (9CI)
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Cas Database |
| Name |
3H-Indolium,1-ethyl-2,3,3-trimethyl-5-sulfo-, inner salt |
EINECS | N/A |
| CAS No. | 146368-07-2 | Density | N/A |
| PSA | 68.59000 | LogP | 3.04630 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C13H17NO3S | Boiling Point | N/A |
| Molecular Weight | 267.349 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1-Ethyl-2,3,3-trimethylindoleninium-5-sulfonate |
Article Data | 21 |
3H-Indolium,1-ethyl-2,3,3-trimethyl-5-sulfo-, inner salt Specification
The 3H-Indolium,1-ethyl-2,3,3-trimethyl-5-sulfo-, inner salt has CAS registry number 146368-07-2. Its molecular formula is C13H17NO3S and molecular weight is 267.34. What's more, its systematic name is 1-Ethyl-2,3,3-trimethyl-3H-indolium-5-sulfonate.
Physical properties about the 3H-Indolium,1-ethyl-2,3,3-trimethyl-5-sulfo-, inner salt are: (1)ACD/LogP: -6.56; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 68.59 Å2.
You can still convert the following datas into molecular structure:
(1) SMILES: [O-]S(=O)(=O)c2cc1c(\[N+](=C(/C1(C)C)C)CC)cc2
(2) InChI: InChI=1/C13H17NO3S/c1-5-14-9(2)13(3,4)11-8-10(18(15,16)17)6-7-12(11)14/h6-8H,5H2,1-4H3
(3) InChIKey: UQVWIROBIAWZFW-UHFFFAOYAY
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