CAS Number505-48-6
Synonymsoctanedinoic acid diethyl ester; EINECS 208-010-9; Suberic acid; MFCD00004428; Octandisaeure-diaethylester; Ethyl suberate; SUBERIC ACID DIETHYL ESTER; 1,8-diethyl octanedioate; DIETHYL SUBERATE; Korksaeurediaethylester; Octanedioic acid; 1,6-hexanedicarboxylic acid; octanedioic acid diethyl ester
Molecular FormulaHOOC(CH2)6COOH
Molecular Weight174.19
Purity98%
Density1.2±0.1 g/cm3
Boiling Point230 °C/15 mmHg (lit.)
Melting Point139-146 °C
Appearancewhite crystal
EINECS208-010-9
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 505-48-6 |
| Catalog No. | 2A-9022360 |
| Chinese Name | 辛二酸 |
| Synonyms | octanedinoic acid diethyl ester; EINECS 208-010-9; Suberic acid; MFCD00004428; Octandisaeure-diaethylester; Ethyl suberate; SUBERIC ACID DIETHYL ESTER; 1,8-diethyl octanedioate; DIETHYL SUBERATE; Korksaeurediaethylester; Octanedioic acid; 1,6-hexanedicarboxylic acid; octanedioic acid diethyl ester |
| Molecular Formula | HOOC(CH2)6COOH |
| Molecular Weight | 174.19 |
| Purity | 98 |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 230 °C/15 mmHg (lit.) |
| Melting Point | 139-146 °C |
| Appearance | white crystal |
| Water Solubility | 0.6 g/L (20 ºC) |
| Storage Condition | Store sealed and placed in a ventilated, dry envir |
| Application | Octanedioic acid was found to be associated with a deficiency of carnitine-formyl-alanine translocase, also known as propylene glycol-carboxylase deficiency. |
| EINECS | 208-010-9 |
| HTC | 2917190090 |
| PubChem ID | 24899642 |
| MDL Number | MFCD00004428 |
| SMILES | OC(=O)CCCCCCC(O)=O |
| InChI | 1S/C8H14O4/c9-7(10)5-3-1-2-4-6-8(11)12/h1-6H2,(H,9,10)(H,11,12) |
| InChI Key | TYFQFVWCELRYAO-UHFFFAOYSA-N |
| Beilstein/REAXYS | 1210161 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | Transport |
| MSDS | msds/22360_1_505_48_6.pdf |
| Bioactivity | Octanedioic acid is found to be associated with carnitine-acylcarnitine translocase deficiency, malonyl-Coa decarboxylase deficiency. Related Catalog Natural Products >> Acids and Aldehydes Research Areas >> Metabolic Disease Target Human Endogenous Metabolite References [1]. Gregersen N, et al. General (medium-chain) acyl-CoA dehydrogenase deficiency (non-ketotic dicarboxylic aciduria): quantitative urinary excretion pattern of 23 biologically significant organic acids in three cases. Clin Chim Acta. 1983 Aug 15;132(2):181-91. Chemical & Physical Properties Density 1.2±0.1 g/cm3 Boiling Point 361.2±25.0 °C at 760 mmHg Melting Point 140-144 °C(lit.) Molecular Formula C8H14O4 Molecular Weight 174.194 Flash Point 186.5±19.7 °C Exact Mass 174.089203 PSA 74.60000 LogP 0.80 Vapour Pressure 0.0±1.7 mmHg at 25°C Index of Refraction 1.476 InChIKey TYFQFVWCELRYAO-UHFFFAOYSA-N SMILES O=C(O)CCCCCCC(=O)O Stability Stable. Combustible. Incompatible with strong oxidizing agents, reducing agents, bases. Water Solubility 0.6 g/L (20 ºC) |
| Use of | Octanedioic acid is found to be associated with carnitine-acylcarnitine translocase deficiency, malonyl-Coa decarboxylase deficiency. Properties Articles49 Name suberic acid Synonym More Synonyms Octanedioic acid Biological Activity Description Octanedioic acid is found to be associated with carnitine-acylcarnitine translocase deficiency, malonyl-Coa decarboxylase deficiency. Related Catalog Natural Products >> Acids and Aldehydes Research Areas >> Metabolic Disease Human Endogenous Metabolite References [1]. Gregersen N, et al. General (medium-chain) acyl-CoA dehydrogenase deficiency (non-ketotic dicarboxylic aciduria): quantitative urinary excretion pattern of 23 biologically significant organic acids in three cases. Clin Chim Acta. 1983 Aug 15;132(2):181-91. Chemical & Physical Properties Molecular Formula C8H14O4 Exact Mass 174.089203 PSA 74.60000 Index of Refraction 1.476 InChIKey TYFQFVWCELRYAO-UHFFFAOYSA-N SMILES O=C(O)CCCCCCC(=O)O Stability Stable. Combustible. Incompatible with strong oxidizing agents, reducing agents, bases. |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 6.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Purity: 0.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: No dangerous goods IMDG Code: No dangerous goods International Air Transport Dangerous Regulations: No 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 Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special precautions for users No data available |
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