(2,5-Dimethylphenyl)acetic acid
(2,5-Dimethylphenyl)acetic acid structure
|
Common Name | (2,5-Dimethylphenyl)acetic acid | ||
|---|---|---|---|---|
| CAS Number | 6331-04-0 | Molecular Weight | 164.201 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 295.1±9.0 °C at 760 mmHg | |
| Molecular Formula | C10H12O2 | Melting Point | 128-132ºC | |
| MSDS | USA | Flash Point | 192.2±13.9 °C | |
Summary: 2,4-Dimethylphenylacetic Acid, also known as (2,5-Dimethylphenyl)acetic acid, has a molecular formula of C10H12O2 and a molecular weight of 164.201. The compound has a熔点of 128-132°C and a沸点of 295.1±9.0 °C, with a密度of 1.1±0.1 g/cm3. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2,4-Dimethylphenylacetic Acid |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 295.1±9.0 °C at 760 mmHg |
| Melting Point | 128-132ºC |
| Molecular Formula | C10H12O2 |
| Molecular Weight | 164.201 |
| Flash Point | 192.2±13.9 °C |
| Exact Mass | 164.083725 |
| PSA | 37.30000 |
| LogP | 2.42 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.542 |
| InChIKey | MWBXCWLRASBZFB-UHFFFAOYSA-N |
| SMILES | Cc1ccc(CC(=O)O)c(C)c1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi: Irritant; |
|---|---|
| Risk Phrases | R36/37/38 |
| Safety Phrases | 37/39-26 |
| HS Code | 2916399090 |
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 8 | |
|---|---|
| DownStream 9 | |
CAS#:68429-53-8
CAS#:7440-44-0
CAS#:473-72-3
CAS#:17879-35-5
CAS#:776279-83-5
CAS#:89-74-7
CAS#:1727-75-9
CAS#:91061-51-7
CAS#:104729-89-7
CAS#:143301-49-9
CAS#:95-63-6
CAS#:854672-44-9
CAS#:96-22-0
CAS#:2234-20-0
CAS#:81561-61-7
CAS#:6597-59-7
CAS#:89722-18-9This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2916399090 |
|---|---|
| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
|
Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
|
|
Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| (2,5-Dimethylphenyl)acetic acid |
| EINECS 237-097-6 |
| MFCD00014369 |
| (2,4-Dimethylphenyl)acetic acid |
| 2-(2,4-dimethylphenyl)acetic acid |
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 2,4-Dimethylphenylacetic Acid? |
| A: Related upstream materials(CAS) of 2,4-Dimethylphenylacetic Acid: 68429-53-8;7440-44-0;473-72-3;17879-35-5;776279-83-5;89-74-7;1727-75-9;91061-51-7. |
| Q: What is the InChIKey of 2,4-Dimethylphenylacetic Acid? |
| A: InChIKey of 2,4-Dimethylphenylacetic Acid is MWBXCWLRASBZFB-UHFFFAOYSA-N. |
| Q: What is the melting point of 2,4-Dimethylphenylacetic Acid? |
| A: Melting point of 2,4-Dimethylphenylacetic Acid is 128-132ºC. |
| Q: What English synonyms does 2,4-Dimethylphenylacetic Acid have? |
| A: English synonyms of 2,4-Dimethylphenylacetic Acid: (2,5-Dimethylphenyl)acetic acid, EINECS 237-097-6, MFCD00014369, (2,4-Dimethylphenyl)acetic acid, 2-(2,4-dimethylphenyl)acetic acid. |
| Q: What is the safety information for 2,4-Dimethylphenylacetic Acid? |
| A: Safety information for 2,4-Dimethylphenylacetic Acid: 37/39-26. |
| Q: What is the SMILES notation of 2,4-Dimethylphenylacetic Acid? |
| A: SMILES notation of 2,4-Dimethylphenylacetic Acid is Cc1ccc(CC(=O)O)c(C)c1. |
| Q: What is the English name of 2,4-Dimethylphenylacetic Acid? |
| A: The English name of 2,4-Dimethylphenylacetic Acid is 2,4-Dimethylphenylacetic Acid. |
| Q: What is the CAS number of 2,4-Dimethylphenylacetic Acid? |
| A: CAS number of 2,4-Dimethylphenylacetic Acid is 6331-04-0. |
| Q: What is the molecular weight of 2,4-Dimethylphenylacetic Acid? |
| A: Molecular weight of 2,4-Dimethylphenylacetic Acid is 164.201. |
| Q: What are the downstream products of 2,4-Dimethylphenylacetic Acid? |
| A: Related downstream products(CAS) of 2,4-Dimethylphenylacetic Acid: 104729-89-7;143301-49-9;95-63-6;854672-44-9;96-22-0;2234-20-0;81561-61-7;6597-59-7;89722-18-9. |
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. |