CAS Number21434-91-3
SynonymsCapobenic Acid; Trifartine; 6-(3,4,5-Trimethoxy-benzoylamino)-hexanoic acid; 6-(3,4,5-trimethoxybenzamido)hexanoic acid
Molecular FormulaC16H23NO6
Molecular Weight325.35700
Purity98.00%
Density1.166g/cm3
Boiling Point472.8ºC at 760 mmHg
Melting Point121-123°
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 21434-91-3 |
| Catalog No. | 2A-9009562 |
| Chinese Name | 克冠酸 |
| Synonyms | Capobenic Acid; Trifartine; 6-(3,4,5-Trimethoxy-benzoylamino)-hexanoic acid; 6-(3,4,5-trimethoxybenzamido)hexanoic acid |
| Molecular Formula | C16H23NO6 |
| Molecular Weight | 325.35700 |
| Purity | 98.00 |
| Density | 1.166g/cm3 |
| Boiling Point | 472.8ºC at 760 mmHg |
| Melting Point | 121-123° |
| Application | 6-(3,4,5-Trimethoxybenzamide)caproic acid is an antiarrhythmic agent [1]. |
| HTC | 2924299090 |
| SMILES | COc1cc(C(=O)NCCCCCC(=O)O)cc(OC)c1OC |
| InChI | InChI=1S/C16H23NO6/c1-21-12-9-11(10-13(22-2)15(12)23-3)16(20)17-8-6-4-5-7-14(18)19/h9-10H,4-8H2,1-3H3,(H,17,20)(H,18,19) |
| InChI Key | MPTXLVRHYGBOQY-UHFFFAOYSA-N |
| Use of | 6-(3,4,5-Trimethoxybenzamido)hexanoic acid is an antiarrythmic agent[1]. Properties Name 6-[(3,4,5-trimethoxybenzoyl)amino]hexanoic acid Synonym More Synonyms Biological Activity Description 6-(3,4,5-Trimethoxybenzamido)hexanoic acid is an antiarrythmic agent[1]. Related Catalog Research Areas >> Cardiovascular Disease Signaling Pathways >> Others >> Others References [1]. Shipchandler, M. T., et al. A synthesis of 6-(3,4,5-trimethoxyphthalimido)hexanoic acid. Chemical & Physical Properties Molecular Formula C16H23NO6 Exact Mass 325.15300 PSA 94.09000 LogP 2.47810 Index of Refraction 1.518 InChIKey MPTXLVRHYGBOQY-UHFFFAOYSA-N Safety Information HS Code 2924299090 Synthetic Route Total: 1 Page Trimethylgalloy... CAS#:4521-61-3 6-Aminocaproic acid CAS#:60-32-2 6-(3,4,5-Trimet... CAS#:21434-91-3 Literature: Bespalov; Gorchakova; Dolgo-Saburov; Kuznetsov; Kosmachev; Libman; Podosinovikova; Ramsh; Shelkovnikov Pharmaceutical Chemistry Journal, 1997 , vol. 31, # 7 p. 361 - 364 Precursor & DownStream Precursor 2 CAS#:4521-61-3 Trimethylgalloy... CAS#:60-32-2 6-Aminocaproic acid DownStream 0 |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 30.0% |
| Transport Info | Product name: Summary 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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