3-(4-BROMOBENZOYL)PROPIONIC ACID
3-(4-BROMOBENZOYL)PROPIONIC ACID structure
|
Common Name | 3-(4-BROMOBENZOYL)PROPIONIC ACID | ||
|---|---|---|---|---|
| CAS Number | 6340-79-0 | Molecular Weight | 257.08100 | |
| Density | 1.56 g/cm3 | Boiling Point | 428ºC at 760 mmHg | |
| Molecular Formula | C10H9BrO3 | Melting Point | 148-152 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 212.6ºC | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-(4-Bromobenzoyl)propionic 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 | 1.56 g/cm3 |
|---|---|
| Boiling Point | 428ºC at 760 mmHg |
| Melting Point | 148-152 °C(lit.) |
| Molecular Formula | C10H9BrO3 |
| Molecular Weight | 257.08100 |
| Flash Point | 212.6ºC |
| Exact Mass | 255.97400 |
| PSA | 54.37000 |
| LogP | 2.49660 |
| InChIKey | ZODFRCZNTXLDDW-UHFFFAOYSA-N |
| SMILES | O=C(O)CCC(=O)c1ccc(Br)cc1 |
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.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi: Irritant; |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| HS Code | 2918300090 |
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 | |
|---|---|
| DownStream 10 | |
CAS#:108-30-5
CAS#:108-86-1
CAS#:20005-42-9
CAS#:85060-86-2
CAS#:51765-77-6
CAS#:30913-86-1
CAS#:2403-27-2![[2-bromo-3-(4-bromo-phenyl)-3-oxo-1-phenyl-propyl]-malonic acid dimethyl ester Structure](https://image.chemsrc.com/caspic/362/861356-40-3.png)
CAS#:861356-40-3
CAS#:861777-41-5![[1-(α-bromo-benzyl)-2-(4-bromo-phenyl)-2-oxo-ethyl]-malonic acid Structure](https://image.chemsrc.com/caspic/265/861799-19-1.png)
CAS#:861799-19-1
CAS#:111773-13-8
CAS#:105986-54-7
CAS#:35656-89-4
CAS#:1821-12-1
CAS#:32281-97-3
CAS#:36725-37-8
CAS#:36330-85-5
CAS#:30913-87-2
CAS#:586-76-5
CAS#:79-10-7This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2918300090 |
|---|---|
| Summary | 2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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An alternative route to syntheses of aryl keto acids in a chloroaluminate ionic liquid. Mohile SS, et al.
J. Chem. Res. (M) 10 , 650-651, (2003)
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This table contains target information, in‑vitro & in‑vivo assay data for this compound.
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| EINECS 228-732-8 |
| MFCD00016563 |
| 4-(4-bromophenyl)-4-oxobutanoic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the boiling point of 3-(4-Bromobenzoyl)propionic Acid? |
| A: Boiling point of 3-(4-Bromobenzoyl)propionic Acid is 428ºC at 760 mmHg. |
| Q: What are the downstream products of 3-(4-Bromobenzoyl)propionic Acid? |
| A: Related downstream products(CAS) of 3-(4-Bromobenzoyl)propionic Acid: 111773-13-8;105986-54-7;35656-89-4;1821-12-1;32281-97-3;36725-37-8;36330-85-5;30913-87-2;586-76-5;79-10-7. |
| Q: What is the polar surface area (PSA) of 3-(4-Bromobenzoyl)propionic Acid? |
| A: Polar surface area (PSA) of 3-(4-Bromobenzoyl)propionic Acid is 54.37000. |
| Q: What is the molecular formula of 3-(4-Bromobenzoyl)propionic Acid? |
| A: Molecular formula of 3-(4-Bromobenzoyl)propionic Acid is C10H9BrO3. |
| Q: What is the safety information for 3-(4-Bromobenzoyl)propionic Acid? |
| A: Safety information for 3-(4-Bromobenzoyl)propionic Acid: S26-S36. |
| Q: What English synonyms does 3-(4-Bromobenzoyl)propionic Acid have? |
| A: English synonyms of 3-(4-Bromobenzoyl)propionic Acid: EINECS 228-732-8, MFCD00016563, 4-(4-bromophenyl)-4-oxobutanoic acid. |
| Q: What are the upstream materials of 3-(4-Bromobenzoyl)propionic Acid? |
| A: Related upstream materials(CAS) of 3-(4-Bromobenzoyl)propionic Acid: 108-30-5;108-86-1;20005-42-9;85060-86-2;51765-77-6;30913-86-1;2403-27-2;861356-40-3;861777-41-5;861799-19-1. |
| Q: What is the LogP of 3-(4-Bromobenzoyl)propionic Acid? |
| A: LogP of 3-(4-Bromobenzoyl)propionic Acid is 2.49660. |
| Q: What is the InChIKey of 3-(4-Bromobenzoyl)propionic Acid? |
| A: InChIKey of 3-(4-Bromobenzoyl)propionic Acid is ZODFRCZNTXLDDW-UHFFFAOYSA-N. |
| Q: What is the CAS number of 3-(4-Bromobenzoyl)propionic Acid? |
| A: CAS number of 3-(4-Bromobenzoyl)propionic Acid is 6340-79-0. |
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. |