1-Iodo-2-methoxy-4-nitrobenzene
1-Iodo-2-methoxy-4-nitrobenzene structure
|
Common Name | 1-Iodo-2-methoxy-4-nitrobenzene | ||
|---|---|---|---|---|
| CAS Number | 5458-84-4 | Molecular Weight | 279.032 | |
| Density | 1.9±0.1 g/cm3 | Boiling Point | 341.2±32.0 °C at 760 mmHg | |
| Molecular Formula | C7H6INO3 | Melting Point | 128-130ºC | |
| MSDS | N/A | Flash Point | 160.1±25.1 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-Iodo-5-nitroanisole |
|---|---|
| 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 | 1.9±0.1 g/cm3 |
|---|---|
| Boiling Point | 341.2±32.0 °C at 760 mmHg |
| Melting Point | 128-130ºC |
| Molecular Formula | C7H6INO3 |
| Molecular Weight | 279.032 |
| Flash Point | 160.1±25.1 °C |
| Exact Mass | 278.939240 |
| PSA | 55.05000 |
| LogP | 3.30 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.629 |
| InChIKey | RBFWMPRFYROKPI-UHFFFAOYSA-N |
| SMILES | COc1cc([N+](=O)[O-])ccc1I |
| Storage condition | Refrigerated. |
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.
| Hazard Codes | Xi |
|---|---|
| Risk Phrases | 36/37/38 |
| Safety Phrases | 26-36/37/39 |
| HS Code | 2909309090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~97%
1-Iodo-2-methox... CAS#:5458-84-4 |
| Literature: Vajpayee, Vaishali; Moon, Mi Eun; Lee, Sunmi; Ravikumar, Sambandam; Kim, Hyunuk; Ahn, Byungchan; Choi, Seoyoon; Hong, Soon Ho; Chi, Ki-Whan Tetrahedron, 2013 , vol. 69, # 16 p. 3511 - 3517 |
|
~0%
1-Iodo-2-methox... CAS#:5458-84-4 |
| Literature: Saeki, Tomoyuki; Son, Eun-Cheol; Tamao, Kohei Bulletin of the Chemical Society of Japan, 2005 , vol. 78, # 9 p. 1654 - 1658 |
|
~%
1-Iodo-2-methox... CAS#:5458-84-4 |
| Literature: Bulletin of the Chemical Society of Japan, , vol. 78, # 9 p. 1654 - 1658 |
|
~%
1-Iodo-2-methox... CAS#:5458-84-4 |
| Literature: P. Ch. S., p. 238 Chem. Zentralbl., , vol. 72, # II p. 97 |
|
~%
1-Iodo-2-methox... CAS#:5458-84-4 |
| Literature: P. Ch. S., p. 238 Chem. Zentralbl., , vol. 72, # II p. 97 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 4 | |
CAS#:106877-20-7
CAS#:118450-89-8![4-[(3-chloro-2-fluorophenyl)methyl]-3-methoxyaniline structure](https://image.chemsrc.com/caspic/345/882535-01-5.png)
CAS#:882535-01-5
CAS#:453560-74-2This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2909309090 |
|---|---|
| Summary | 2909309090 other aromatic ethers and their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% 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.
| 1-Iodo-2-methoxy-4-nitrobenzene |
| MFCD00024590 |
| 2-Iodo-5-nitrophenyl methyl ether |
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 2-Iodo-5-nitroanisole? |
| A: Molecular formula of 2-Iodo-5-nitroanisole is C7H6INO3. |
| Q: What is the boiling point of 2-Iodo-5-nitroanisole? |
| A: Boiling point of 2-Iodo-5-nitroanisole is 341.2±32.0 °C at 760 mmHg. |
| Q: What are the downstream products of 2-Iodo-5-nitroanisole? |
| A: Related downstream products(CAS) of 2-Iodo-5-nitroanisole: 106877-20-7;118450-89-8;882535-01-5;453560-74-2. |
| Q: What is the melting point of 2-Iodo-5-nitroanisole? |
| A: Melting point of 2-Iodo-5-nitroanisole is 128-130ºC. |
| Q: What is the polar surface area (PSA) of 2-Iodo-5-nitroanisole? |
| A: Polar surface area (PSA) of 2-Iodo-5-nitroanisole is 55.05000. |
| Q: What are the storage conditions for 2-Iodo-5-nitroanisole? |
| A: Storage conditions for 2-Iodo-5-nitroanisole: Refrigerated. |
| Q: What is the CAS number of 2-Iodo-5-nitroanisole? |
| A: CAS number of 2-Iodo-5-nitroanisole is 5458-84-4. |
| Q: What are the upstream materials of 2-Iodo-5-nitroanisole? |
| A: Related upstream materials(CAS) of 2-Iodo-5-nitroanisole: 97-52-9;869373-61-5;869373-72-8;197243-46-2;121-88-0. |
| Q: What is the English name of 2-Iodo-5-nitroanisole? |
| A: The English name of 2-Iodo-5-nitroanisole is 2-Iodo-5-nitroanisole. |
| Q: What is the molecular weight of 2-Iodo-5-nitroanisole? |
| A: Molecular weight of 2-Iodo-5-nitroanisole is 279.032. |
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. |