m-Tolualdehyde structure
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Common Name | m-Tolualdehyde | ||
|---|---|---|---|---|
| CAS Number | 620-23-5 | Molecular Weight | 120.148 | |
| Density | 1.0±0.1 g/cm3 | Boiling Point | 199.0±0.0 °C at 760 mmHg | |
| Molecular Formula | C8H8O | Melting Point | N/A | |
| MSDS | Chinese USA | Flash Point | 78.3±0.0 °C | |
Use of m-Tolualdehydem-Tolualdehyde (3-Methylbenzaldehyde) is a tolualdehyde compound with the methyl substituent at the 3-position. m-Tolualdehyde can be used as a food additive. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | m-tolualdehyde |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | m-Tolualdehyde (3-Methylbenzaldehyde) is a tolualdehyde compound with the methyl substituent at the 3-position. m-Tolualdehyde can be used as a food additive. |
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| Related Catalog | |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.0±0.1 g/cm3 |
|---|---|
| Boiling Point | 199.0±0.0 °C at 760 mmHg |
| Molecular Formula | C8H8O |
| Molecular Weight | 120.148 |
| Flash Point | 78.3±0.0 °C |
| Exact Mass | 120.057518 |
| PSA | 17.07000 |
| LogP | 2.10 |
| Vapour Pressure | 0.3±0.3 mmHg at 25°C |
| Index of Refraction | 1.558 |
| InChIKey | OVWYEQOVUDKZNU-UHFFFAOYSA-N |
| SMILES | Cc1cccc(C=O)c1 |
| Water Solubility | slightly soluble |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Personal Protective Equipment | Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US) |
|---|---|
| Hazard Codes | Xi:Irritant; |
| Risk Phrases | R36/38 |
| Safety Phrases | S23-S24/25-S37/39-S26 |
| RIDADR | NA 1993 / PGIII |
| WGK Germany | 3 |
| RTECS | CU7033700 |
| HS Code | 29122900 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
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| DownStream 10 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2912299000 |
|---|---|
| Summary | 2912299000. other cyclic aldehydes without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Inhibition of rat respiratory-tract cytochrome P-450 isozymes following inhalation of m-Xylene: possible role of metabolites.
J. Toxicol. Environ. Health A 66(12) , 1133-43, (2003) Xylene is used as a solvent in paints, cleaning agents, and gasoline. Exposure occurs primarily by inhalation. The volatility and lipophilicity of the xylenes make the lung and nasal mucosa the primar... |
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Oxidation of tolualdehydes to toluic acids catalyzed by cytochrome P450-dependent aldehyde oxygenase in the mouse liver.
Drug Metab. Dispos. 23(2) , 261-5, (1995) Mouse hepatic microsomal enzymes catalyzed the oxidation of o-, m-, and p-tolualdehydes, intermediate metabolites of xylene, to the corresponding toluic acids. Cofactor requirement for the catalytic a... |
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[Secondary metabolites of seaweed endophytic fungi ZJ27 in the South China Sea coast].
Zhong Yao Cai 34(4) , 544-6, (2011) To study the secondary metabolites of coastal seaweed endophytic fungi ZJ27.The compounds were isolated by chromatographic technique. The structures were identified by comprehensive physic-chemical pr... |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Inhibition Assay from Article 10.1080/14756360310001613094: "Inhibitory effects on mu...
Source: BindingDB
Target: N/A
External Id: BindingDB_5258_1
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Name: Inhibition of NO711 binding to mouse GAT1 expressed in HEK293 cell membranes assessed...
Source: ChEMBL
Target: Sodium- and chloride-dependent GABA transporter 1
External Id: CHEMBL4342201
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-tolualdehyde |
| m-Tolualdehyde |
| Benzaldehyde,3-methyl |
| 3-Tolylaldehyde |
| 5-methylbenzaldehyde |
| 3-Methylbenzaldehyde |
| 3-Me-benzaldehyde |
| 3-methyl-benzaldehyde |
| m-methyl-benzaldehyde |
| EINECS 210-632-0 |
| MFCD00003374 |
| m-Toluylaldehyde |
| m-Tolyl aldehyde |
| 3-Methylbenzolcarbaldehyd |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the upstream materials of m-tolualdehyde? |
| A: Related upstream materials(CAS) of m-tolualdehyde: 201230-82-2;625-95-6;120158-57-8;587-03-1;99-04-7;620-22-4;100-80-1;1711-06-4;52707-50-3;591-17-3. |
| Q: What is the SMILES notation of m-tolualdehyde? |
| A: SMILES notation of m-tolualdehyde is Cc1cccc(C=O)c1. |
| Q: What is the molecular formula of m-tolualdehyde? |
| A: Molecular formula of m-tolualdehyde is C8H8O. |
| Q: What English synonyms does m-tolualdehyde have? |
| A: English synonyms of m-tolualdehyde: 3-tolualdehyde, m-Tolualdehyde, Benzaldehyde,3-methyl, 3-Tolylaldehyde, 5-methylbenzaldehyde, 3-Methylbenzaldehyde, 3-Me-benzaldehyde, 3-methyl-benzaldehyde, m-methyl-benzaldehyde, EINECS 210-632-0, MFCD00003374, m-Toluylaldehyde, m-Tolyl aldehyde, 3-Methylbenzolcarbaldehyd. |
| Q: What are the downstream products of m-tolualdehyde? |
| A: Related downstream products(CAS) of m-tolualdehyde: 1082041-78-8;55755-17-4;39627-61-7;3277-78-9;3751-48-2;92367-45-8;4593-38-8;39180-84-2;51772-30-6;22568-43-0. |
| Q: What is the boiling point of m-tolualdehyde? |
| A: Boiling point of m-tolualdehyde is 199.0±0.0 °C at 760 mmHg. |
| Q: What is the safety information for m-tolualdehyde? |
| A: Safety information for m-tolualdehyde: S23-S24/25-S37/39-S26. |
| Q: What are the uses of m-tolualdehyde? |
| A: Main uses of m-tolualdehyde: m-Tolualdehyde (3-Methylbenzaldehyde) is a tolualdehyde compound with the methyl substituent at the 3-position. m-Tolualdehyde can be used as a food additive. |
| Q: How is the water solubility of m-tolualdehyde? |
| A: Water solubility of m-tolualdehyde: slightly soluble. |
| Q: What is the LogP of m-tolualdehyde? |
| A: LogP of m-tolualdehyde is 2.10. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |
| Henan Tianfu Chemical Co., Ltd. |
| Zhongshan Xingrui Chemical Co. , Ltd. |