5-Bromo-2-anisaldehyde
5-Bromo-2-anisaldehyde structure
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Common Name | 5-Bromo-2-anisaldehyde | ||
|---|---|---|---|---|
| CAS Number | 25016-01-7 | Molecular Weight | 215.044 | |
| Density | 1.5±0.1 g/cm3 | Boiling Point | 289.1±20.0 °C at 760 mmHg | |
| Molecular Formula | C8H7BrO2 | Melting Point | 116-119 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 128.7±21.8 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 5-bromo-2-methoxybenzaldehyde |
|---|---|
| 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 | 289.1±20.0 °C at 760 mmHg |
| Melting Point | 116-119 °C(lit.) |
| Molecular Formula | C8H7BrO2 |
| Molecular Weight | 215.044 |
| Flash Point | 128.7±21.8 °C |
| Exact Mass | 213.962936 |
| PSA | 26.30000 |
| LogP | 2.85 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.585 |
| InChIKey | IJIBRSFAXRFPPN-UHFFFAOYSA-N |
| SMILES | COc1ccc(Br)cc1C=O |
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 | H302 |
| Personal Protective Equipment | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
| Hazard Codes | Xi:Irritant; |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S24/25 |
| 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 10 | |
|---|---|
| DownStream 10 | |
CAS#:135-02-4
CAS#:77-78-1
CAS#:1761-61-1
CAS#:74-88-4
CAS#:612-16-8
CAS#:21702-84-1
CAS#:68-12-2
CAS#:104-92-7
CAS#:4885-02-3
CAS#:14804-31-0
CAS#:35431-26-6
CAS#:37942-01-1
CAS#:21962-53-8
CAS#:185244-57-9
CAS#:190270-76-9
CAS#:185244-58-0
CAS#:19652-29-0
CAS#:213620-52-1
CAS#:2199-87-3
CAS#:81224-16-0This 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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22. Stereochemistry of arylidenecyanoacetic acids and arylarylideneacetonitriles.
J. Chem. Soc. , 119-124, (1953)
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Spectroscopic (FT-IR and FT-Raman) studies, NBO, HOMO-LUMO, NMR analyses and thermodynamics functions of 5-bromo-2-methoxybenzaldehyde.
Spectrochim. Acta. A. Mol. Biomol. Spectrosc. 106 , 262-74, (2013) The (FT-IR and FT-Raman) spectral properties of 5-bromo-2-methoxybenzaldehyde (BMB) are studied using density functional theory (DFT) employing B3LYP/6-311++G (d) and B3LYP/6-311++G (d,p) levels of th... |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 5-Bromo-2-anisaldehyde |
| o-Anisaldehyde,5-bromo |
| Benzaldehyde,5-bromo-2-methoxy |
| VHR CE FO1 |
| 5-bromoanisaldehyde |
| 5-Bromo-2-methoxybenzaldehyde |
| 2-methoxy-5-bromo-benzaldehyde |
| EINECS 246-564-3 |
| 5-Bromo-o-anisaldehyde |
| 5-bromo-2-methoxysalicylaldehyde |
| MFCD00003347 |
| 5-Bromo-2-anisaldehyde(5-Bromo-2-methoxybenzaldehyde) |
| 3-bromo-6-methoxybenzaldehyde |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the safety information for 5-bromo-2-methoxybenzaldehyde? |
| A: Safety information for 5-bromo-2-methoxybenzaldehyde: S24/25. |
| Q: What are the upstream materials of 5-bromo-2-methoxybenzaldehyde? |
| A: Related upstream materials(CAS) of 5-bromo-2-methoxybenzaldehyde: 135-02-4;77-78-1;1761-61-1;74-88-4;612-16-8;21702-84-1;68-12-2;104-92-7;4885-02-3;14804-31-0. |
| Q: What is the English name of 5-bromo-2-methoxybenzaldehyde? |
| A: The English name of 5-bromo-2-methoxybenzaldehyde is 5-bromo-2-methoxybenzaldehyde. |
| Q: What is the molecular weight of 5-bromo-2-methoxybenzaldehyde? |
| A: Molecular weight of 5-bromo-2-methoxybenzaldehyde is 215.044. |
| Q: What is the boiling point of 5-bromo-2-methoxybenzaldehyde? |
| A: Boiling point of 5-bromo-2-methoxybenzaldehyde is 289.1±20.0 °C at 760 mmHg. |
| Q: What is the polar surface area (PSA) of 5-bromo-2-methoxybenzaldehyde? |
| A: Polar surface area (PSA) of 5-bromo-2-methoxybenzaldehyde is 26.30000. |
| Q: What is the molecular formula of 5-bromo-2-methoxybenzaldehyde? |
| A: Molecular formula of 5-bromo-2-methoxybenzaldehyde is C8H7BrO2. |
| Q: What English synonyms does 5-bromo-2-methoxybenzaldehyde have? |
| A: English synonyms of 5-bromo-2-methoxybenzaldehyde: 5-Bromo-2-anisaldehyde, o-Anisaldehyde,5-bromo, Benzaldehyde,5-bromo-2-methoxy, VHR CE FO1, 5-bromoanisaldehyde, 5-Bromo-2-methoxybenzaldehyde, 2-methoxy-5-bromo-benzaldehyde, EINECS 246-564-3, 5-Bromo-o-anisaldehyde, 5-bromo-2-methoxysalicylaldehyde, MFCD00003347, 5-Bromo-2-anisaldehyde(5-Bromo-2-methoxybenzaldehyde), 3-bromo-6-methoxybenzaldehyde. |
| Q: What is the LogP of 5-bromo-2-methoxybenzaldehyde? |
| A: LogP of 5-bromo-2-methoxybenzaldehyde is 2.85. |
| Q: What is the InChIKey of 5-bromo-2-methoxybenzaldehyde? |
| A: InChIKey of 5-bromo-2-methoxybenzaldehyde is IJIBRSFAXRFPPN-UHFFFAOYSA-N. |
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. |