3-Bromo-4,5-dimethoxybenzaldehyde
3-Bromo-4,5-dimethoxybenzaldehyde structure
|
Common Name | 3-Bromo-4,5-dimethoxybenzaldehyde | ||
|---|---|---|---|---|
| CAS Number | 6948-30-7 | Molecular Weight | 245.070 | |
| Density | 1.5±0.1 g/cm3 | Boiling Point | 313.8±37.0 °C at 760 mmHg | |
| Molecular Formula | C9H9BrO3 | Melting Point | 63-64 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 143.6±26.5 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-Bromo-4,5-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 | 1.5±0.1 g/cm3 |
|---|---|
| Boiling Point | 313.8±37.0 °C at 760 mmHg |
| Melting Point | 63-64 °C(lit.) |
| Molecular Formula | C9H9BrO3 |
| Molecular Weight | 245.070 |
| Flash Point | 143.6±26.5 °C |
| Exact Mass | 243.973495 |
| PSA | 35.53000 |
| LogP | 2.40 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.568 |
| InChIKey | ICVODPFGWCUVJC-UHFFFAOYSA-N |
| SMILES | COc1cc(C=O)cc(Br)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 |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S37/39 |
| 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.
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~98%
3-Bromo-4,5-dim... CAS#:6948-30-7 |
| Literature: Nakanishi; Suzuki Organic letters, 1999 , vol. 1, # 7 p. 985 - 988 |
|
~94%
3-Bromo-4,5-dim... CAS#:6948-30-7 |
| Literature: Tadross, Pamela M.; Gilmore, Christopher D.; Bugga, Pradeep; Virgil, Scott C.; Stoltz, Brian M. Organic Letters, 2010 , vol. 12, # 6 p. 1224 - 1227 |
|
~%
3-Bromo-4,5-dim... CAS#:6948-30-7 |
| Literature: Journal of Antibiotics, , vol. 46, # 9 p. 1458 - 1470 |
|
~39%
3-Bromo-4,5-dim... CAS#:6948-30-7 |
| Literature: Sarma, Jagarlapudi A.R.P.; Nagaraju, Akula; Majumdar, Kanak K.; Samuel, Purnima M.; Das, Indira; Roy, Sujit; McGhie, Alistair J. Journal of the Chemical Society. Perkin Transactions 2, 2000 , # 6 p. 1119 - 1123 |
|
~80%
3-Bromo-4,5-dim... CAS#:6948-30-7 |
| Literature: Mao, Jin-Long; Ran, Xiang-Kai; Tian, Jing-Zhen; Jiao, Bo; Zhou, Hong-Lei; Chen, Li; Wang, Zhen-Guo Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 5 p. 1549 - 1553 |
|
~25%
Detail
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| Literature: Tetrahedron Letters, , vol. 49, # 36 p. 5309 - 5311 |
|
~%
3-Bromo-4,5-dim... CAS#:6948-30-7 |
| Literature: Journal of the American Chemical Society, , vol. 51, p. 2194 |
|
~%
3-Bromo-4,5-dim... CAS#:6948-30-7 |
| Literature: Justus Liebigs Annalen der Chemie, , vol. 391, p. 44 |
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~%
3-Bromo-4,5-dim... CAS#:6948-30-7 |
| Literature: Justus Liebigs Annalen der Chemie, , vol. 391, p. 44 |
This 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 lists relevant public references with title, journal and publication metadata for this compound.
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Synthesis and anxiolytic activity of 1-phenyl-2-(4-aryl-1,3,4,5-tetrahydropyrido[2,3-b][1 ,4]diazepin-2-ylidene)-ethanone.
Pharmazie 61(6) , 517-21, (2006) A two-step, general synthesis of 1-phenyl-2-(4-aryl-1,3,4,5-tetrahydropyrido[2,3-b][1,4]diazepin-2-ylidene)-ethanones 3-9 is presented. This synthesis employs a condensation of 2,3-diaminopyridine wit... |
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: 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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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-Bromo-4,5-dimethoxybenzaldehyde |
| EINECS 230-113-2 |
| MFCD00003346 |
| 3-Bromo-4,5-dimethoxy benzaldehyde |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular formula of 3-Bromo-4,5-dimethoxybenzaldehyde? |
| A: Molecular formula of 3-Bromo-4,5-dimethoxybenzaldehyde is C9H9BrO3. |
| Q: What is the LogP of 3-Bromo-4,5-dimethoxybenzaldehyde? |
| A: LogP of 3-Bromo-4,5-dimethoxybenzaldehyde is 2.40. |
| Q: What is the InChIKey of 3-Bromo-4,5-dimethoxybenzaldehyde? |
| A: InChIKey of 3-Bromo-4,5-dimethoxybenzaldehyde is ICVODPFGWCUVJC-UHFFFAOYSA-N. |
| Q: What is the CAS number of 3-Bromo-4,5-dimethoxybenzaldehyde? |
| A: CAS number of 3-Bromo-4,5-dimethoxybenzaldehyde is 6948-30-7. |
| Q: What is the polar surface area (PSA) of 3-Bromo-4,5-dimethoxybenzaldehyde? |
| A: Polar surface area (PSA) of 3-Bromo-4,5-dimethoxybenzaldehyde is 35.53000. |
| Q: What English synonyms does 3-Bromo-4,5-dimethoxybenzaldehyde have? |
| A: English synonyms of 3-Bromo-4,5-dimethoxybenzaldehyde: 3-Bromo-4,5-dimethoxybenzaldehyde, EINECS 230-113-2, MFCD00003346, 3-Bromo-4,5-dimethoxy benzaldehyde. |
| Q: What is the boiling point of 3-Bromo-4,5-dimethoxybenzaldehyde? |
| A: Boiling point of 3-Bromo-4,5-dimethoxybenzaldehyde is 313.8±37.0 °C at 760 mmHg. |
| Q: What is the safety information for 3-Bromo-4,5-dimethoxybenzaldehyde? |
| A: Safety information for 3-Bromo-4,5-dimethoxybenzaldehyde: S26-S37/39. |
| Q: What is the molecular weight of 3-Bromo-4,5-dimethoxybenzaldehyde? |
| A: Molecular weight of 3-Bromo-4,5-dimethoxybenzaldehyde is 245.070. |
| Q: What is the English name of 3-Bromo-4,5-dimethoxybenzaldehyde? |
| A: The English name of 3-Bromo-4,5-dimethoxybenzaldehyde is 3-Bromo-4,5-dimethoxybenzaldehyde. |
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. |