Determine the necessary mass, volume, or concentration for preparing a solution.
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SKU | Size | Availability | Price | Qty |
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I170109-1g | 1g | Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding. | $9.90 | |
I170109-5g | 5g | Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding. | $39.90 | |
I170109-25g | 25g | Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding. | $165.90 |
Synonyms | BETA-2-FURYLACROLEIN | EN300-50843 | J-800077 | FEMA No. 2494 | Q27289372 | CS-W013561 | DTXCID8029151 | .beta.-2-Furylacrolein | J-640075 | 5-17-09-00570 (Beilstein Handbook Reference) | LS-13265 | (E)-3-(uran-2-yl)prop-2-enal | TRANS-.BETA.-2-FURYLACROL |
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Specifications & Purity | ≥97% |
Shipped In | Normal |
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Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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IUPAC Name | (E)-3-(furan-2-yl)prop-2-enal |
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INCHI | InChI=1S/C7H6O2/c8-5-1-3-7-4-2-6-9-7/h1-6H/b3-1+ |
InChi Key | VZIRCHXYMBFNFD-HNQUOIGGSA-N |
Canonical SMILES | C1=COC(=C1)C=CC=O |
Isomeric SMILES | C1=COC(=C1)/C=C/C=O |
WGK Germany | 3 |
PubChem CID | 1549521 |
Molecular Weight | 122.12 |
Flash Point(°F) | 210.2 °F |
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Flash Point(°C) | 99 °C |
Molecular Weight | 122.120 g/mol |
XLogP3 | 1.100 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 2 |
Exact Mass | 122.037 Da |
Monoisotopic Mass | 122.037 Da |
Topological Polar Surface Area | 30.200 Ų |
Heavy Atom Count | 9 |
Formal Charge | 0 |
Complexity | 118.000 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
The total count of all stereochemical bonds | 1 |
Covalently-Bonded Unit Count | 1 |
Pictogram(s) | GHS05, GHS07 |
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Signal | Danger |
Hazard Statements | H314:Causes severe skin burns and eye damage H302:Harmful if swallowed |
Precautionary Statements | P280:Wear protective gloves/protective clothing/eye protection/face protection. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P260:Do not breathe dust/fume/gas/mist/vapors/spray. P270:Do not eat, drink or smoke when using this product. P301+P330+P331:IF SWALLOWED: Rinse mouth. Do NOT induce vomiting. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P363:Wash contaminated clothing before reuse. P330:Rinse mouth. P301+P317:IF SWALLOWED: Get medical help. P305+P354+P338:IF IN EYES: Immediately rinse with water for several minutes. Remove contact lenses if present and easy to do. Continue rinsing. P302+P361+P354:IF ON SKIN: Take off Immediately all contaminated clothing. Immediately rinse with water for several minutes. P316:Get emergency medical help immediately. |
WGK Germany | 3 |
1. Min Li, Ping Zhan, Peng Wang, Honglei Tian, Jingzhang Geng, Lixia Wang. (2023) Characterization of aroma-active compounds changes of Xiecun Huangjius with different aging years based on odor activity values and multivariate analysis. FOOD CHEMISTRY, 405 (134809). [PMID:36368097] [10.1016/j.foodchem.2022.134809] |
1. Min Li, Ping Zhan, Peng Wang, Honglei Tian, Jingzhang Geng, Lixia Wang. (2023) Characterization of aroma-active compounds changes of Xiecun Huangjius with different aging years based on odor activity values and multivariate analysis. FOOD CHEMISTRY, 405 (134809). [PMID:36368097] [10.1016/j.foodchem.2022.134809] |