CAS Number7598-91-6
SynonymsMFCD00044575; ethyl 5-hydroxy-2-methyl-1H-indole-3-carboxylate; EINECS 231-507-7
Molecular FormulaC17H14O4
Molecular Weight282.3
Purity98.00%
Density1.282 g/cm3
Boiling Point406.7ºC at 760 mmHg
Melting Point205-208ºC(lit.)
AppearanceOff-white to light yellowish brown crystalline powder
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 7598-91-6 |
| Catalog No. | 2A-9033823 |
| Chinese Name | 5-羟基-2-甲基吲哚-3-羧酸乙酯 |
| Synonyms | MFCD00044575; ethyl 5-hydroxy-2-methyl-1H-indole-3-carboxylate; EINECS 231-507-7 |
| Molecular Formula | C17H14O4 |
| Molecular Weight | 282.3 |
| Purity | 98.00 |
| Density | 1.282 g/cm3 |
| Boiling Point | 406.7ºC at 760 mmHg |
| Melting Point | 205-208ºC(lit.) |
| Appearance | Off-white to light yellowish brown crystalline powder |
| Storage Condition | Sealed in a cool, dry environment. |
| Application | 5-Hydroxy-2-methyl-1H-indole-3-carboxylic acid ethyl ester is an active compound that can be used to synthesize 2-phenylthiomethylindole derivatives, which are 5-lipoxygenase (5-LO) inhibitors [1]. |
| HTC | 2933990090 |
| MDL Number | MFCD00631149 |
| SMILES | CCOC(=O)c1c(C)[nH]c2ccc(O)cc12 |
| InChI | InChI=1S/C12H13NO3/c1-3-16-12(15)11-7(2)13-10-5-4-8(14)6-9(10)11/h4-6,13-14H,3H2,1-2H3 |
| InChI Key | BSNHKSUAAMJXBB-UHFFFAOYSA-N |
| Hazard Symbols | transportation |
| MSDS | msds/33823_1_7598_91_6.pdf |
| Bioactivity | Ethyl 5-hydroxy-2-methyl-1H-indole-3-carboxylate is an active compound, and can be used in the synthesis of 2-phenylthiomethyl-indole derivatives, 2-phenylthiomethyl-indole derivative is a 5-lipoxygenase (5-LO) inhibitor[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Others >> Others Chemical & Physical Properties Density 1.282 g/cm3 Boiling Point 406.7ºC at 760 mmHg Melting Point 205-208ºC(lit.) Molecular Formula C12H13NO3 Molecular Weight 219.23700 Flash Point 199.7ºC Exact Mass 219.09000 PSA 62.32000 LogP 2.35860 Index of Refraction 1.5270 (estimate) InChIKey BSNHKSUAAMJXBB-UHFFFAOYSA-N SMILES CCOC(=O)c1c(C)[nH]c2ccc(O)cc12 |
| Use of | Ethyl 5-hydroxy-2-methyl-1H-indole-3-carboxylate is an active compound, and can be used in the synthesis of 2-phenylthiomethyl-indole derivatives, 2-phenylthiomethyl-indole derivative is a 5-lipoxygenase (5-LO) inhibitor[1]. Properties Name ethyl 5-hydroxy-2-methylindole-3-carboxylate Synonym More Synonyms Biological Activity Description Ethyl 5-hydroxy-2-methyl-1H-indole-3-carboxylate is an active compound, and can be used in the synthesis of 2-phenylthiomethyl-indole derivatives, 2-phenylthiomethyl-indole derivative is a 5-lipoxygenase (5-LO) inhibitor[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Others >> Others Chemical & Physical Properties Molecular Formula C12H13NO3 Exact Mass 219.09000 PSA 62.32000 LogP 2.35860 Index of Refraction 1.5270 (estimate) InChIKey BSNHKSUAAMJXBB-UHFFFAOYSA-N |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
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