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| SKU | Size | Availability |
Price | Qty |
|---|---|---|---|---|
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T162651-1g
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1g |
4
|
$9.90
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|
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T162651-5g
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5g |
1
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$26.90
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| Synonyms | Q67879856 | D94696 | LROJZZICACKNJL-UHFFFAOYSA- | DTXSID80206482 | MFCD00017713 | SB85343 | InChI=1/C10H12O/c1-7-4-9(3)10(6-11)5-8(7)2/h4-6H,1-3H3 | CHEBI:192931 | Z104492886 | 2,4,5-Trimethylbenzaldehyde, 90% | 2,4,5-Trimethylbenzaldehyde; Duraldehyde; D |
|---|---|
| Specifications & Purity | ≥97% |
| Storage Temp | Argon charged |
| Shipped In | Normal |
| Product Description |
Dipole moments of 2,4,5-trimethylbenzaldehyde (TMB) isolated in a durene host crystal have been reported to be 1.65 ± 0.09D (difference between the ground state and the lowest singlet) and 1.05 ± 0.06D (difference between the ground state and triplet excited states).TMB has been identified as one of the major volatile constituent present in the leave extracts of Eryngium foetidum L.Based on the phosphorescence excitation and Stark spectral data, it has been observed that a change in temperature and electric field causes a change in the dipole moment of the compound. |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Benzoyl derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzoyl derivatives |
| Alternative Parents | Benzaldehydes Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Benzoyl - Benzaldehyde - Aryl-aldehyde - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aldehyde - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-). |
| External Descriptors | Not available |
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| Pubchem Sid | 488182731 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488182731 |
| IUPAC Name | 2,4,5-trimethylbenzaldehyde |
| INCHI | InChI=1S/C10H12O/c1-7-4-9(3)10(6-11)5-8(7)2/h4-6H,1-3H3 |
| InChIKey | LROJZZICACKNJL-UHFFFAOYSA-N |
| Smiles | CC1=CC(=C(C=C1C)C=O)C |
| Isomeric SMILES | CC1=CC(=C(C=C1C)C=O)C |
| PubChem CID | 22013 |
| Molecular Weight | 148.21 |
| Reaxy-Rn | 2040713 |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | May 09, 2025 | T162651 | |
| Certificate of Analysis | May 09, 2025 | T162651 | |
| Certificate of Analysis | May 09, 2025 | T162651 | |
| Certificate of Analysis | May 09, 2025 | T162651 | |
| Certificate of Analysis | Aug 15, 2024 | T162651 | |
| Certificate of Analysis | Aug 15, 2024 | T162651 | |
| Certificate of Analysis | Sep 18, 2023 | T162651 | |
| Certificate of Analysis | Sep 18, 2023 | T162651 | |
| Certificate of Analysis | Sep 29, 2022 | T162651 |
| Solubility | soluble in MeOH. |
|---|---|
| Sensitivity | air sensitive |
| Boil Point(°C) | 243°C |
| Melt Point(°C) | 41-46 °C |
| Molecular Weight | 148.200 g/mol |
| XLogP3 | 2.500 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 148.089 Da |
| Monoisotopic Mass | 148.089 Da |
| Topological Polar Surface Area | 17.100 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 142.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
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