Benzaldehyde,5-bromo-2,3-dimethoxy
Benzaldehyde,5-bromo-2,3-dimethoxy structure
|
Common Name | Benzaldehyde,5-bromo-2,3-dimethoxy | ||
|---|---|---|---|---|
| CAS Number | 71295-21-1 | Molecular Weight | 245.07000 | |
| Density | 1.482g/cm3 | Boiling Point | 312.7ºC at 760 mmHg | |
| Molecular Formula | C9H9BrO3 | Melting Point | 81-84ºC(lit.) | |
| MSDS | Chinese USA | Flash Point | 142.9ºC | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 5-bromo-2,3-dimethoxybenzaldehyde |
|---|---|
| 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 | 1.482g/cm3 |
|---|---|
| Boiling Point | 312.7ºC at 760 mmHg |
| Melting Point | 81-84ºC(lit.) |
| Molecular Formula | C9H9BrO3 |
| Molecular Weight | 245.07000 |
| Flash Point | 142.9ºC |
| Exact Mass | 243.97400 |
| PSA | 35.53000 |
| LogP | 2.27880 |
| Index of Refraction | 1.567 |
| InChIKey | RVMWFOFQRYTRHZ-UHFFFAOYSA-N |
| SMILES | COc1cc(Br)cc(C=O)c1OC |
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 | 36/37/38 |
| Safety Phrases | 26-36 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| HS Code | 2913000090 |
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 7 | |
|---|---|
| DownStream 9 | |
CAS#:107188-74-9
CAS#:164670-73-9
CAS#:29865-90-5
CAS#:107188-87-4
CAS#:72517-23-8
CAS#:7507-91-7
CAS#:86232-34-0
CAS#:89328-88-1
CAS#:89328-89-2This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2913000090 |
|---|---|
| Summary | HS: 2913000090 halogenated, sulphonated, nitrated or nitrosated derivatives of products of heading 2912 Educational tariff:17.0% Tax rebate rate:9.0% Regulatory conditions:none Most favored nation tariff:5.5% General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: qHTS screening for TAG (triacylglycerol) accumulators in algae
Source: 11812
Target: N/A
External Id: FATTTLab-Algae-Lipid
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Name: Small-molecule inhibitors of ST2 (IL1RL1)
Source: 20881
Target: interleukin-1 receptor-like 1 isoform [homo sapiens]
External Id: ST2_IL33_Inhibitors_Primary_Screening_77700
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Name: Alphascreen assay for small molecules abrogating mHTT-CaM Interaction
Source: 24983
Target: Huntingtin
External Id: KUHTS-Muma KU-CaM-Htt INH-01
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Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
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|
Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN
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|
Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 5-Brom-2,3-dimethoxy-benzaldehyd |
| MFCD02611624 |
| 2,3-dimethoxy-5-bromobenzaldehyde |
| 5-bromo-2,3-dimethoxy-benzaldehyde |
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 5-bromo-2,3-dimethoxybenzaldehyde? |
| A: Related upstream materials(CAS) of 5-bromo-2,3-dimethoxybenzaldehyde: 86-51-1;5034-74-2;77-78-1;74-88-4;148-53-8;7726-95-6;64-19-7. |
| Q: What is the molecular formula of 5-bromo-2,3-dimethoxybenzaldehyde? |
| A: Molecular formula of 5-bromo-2,3-dimethoxybenzaldehyde is C9H9BrO3. |
| Q: What is the InChIKey of 5-bromo-2,3-dimethoxybenzaldehyde? |
| A: InChIKey of 5-bromo-2,3-dimethoxybenzaldehyde is RVMWFOFQRYTRHZ-UHFFFAOYSA-N. |
| Q: What is the molecular weight of 5-bromo-2,3-dimethoxybenzaldehyde? |
| A: Molecular weight of 5-bromo-2,3-dimethoxybenzaldehyde is 245.07000. |
| Q: What is the melting point of 5-bromo-2,3-dimethoxybenzaldehyde? |
| A: Melting point of 5-bromo-2,3-dimethoxybenzaldehyde is 81-84ºC(lit.). |
| Q: What is the polar surface area (PSA) of 5-bromo-2,3-dimethoxybenzaldehyde? |
| A: Polar surface area (PSA) of 5-bromo-2,3-dimethoxybenzaldehyde is 35.53000. |
| Q: What is the SMILES notation of 5-bromo-2,3-dimethoxybenzaldehyde? |
| A: SMILES notation of 5-bromo-2,3-dimethoxybenzaldehyde is COc1cc(Br)cc(C=O)c1OC. |
| Q: What is the LogP of 5-bromo-2,3-dimethoxybenzaldehyde? |
| A: LogP of 5-bromo-2,3-dimethoxybenzaldehyde is 2.27880. |
| Q: What are the downstream products of 5-bromo-2,3-dimethoxybenzaldehyde? |
| A: Related downstream products(CAS) of 5-bromo-2,3-dimethoxybenzaldehyde: 107188-74-9;164670-73-9;29865-90-5;107188-87-4;72517-23-8;7507-91-7;86232-34-0;89328-88-1;89328-89-2. |
| Q: What is the safety information for 5-bromo-2,3-dimethoxybenzaldehyde? |
| A: Safety information for 5-bromo-2,3-dimethoxybenzaldehyde: 26-36. |
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. |