Benzene,1-nitro-4-(phenylmethyl)
Benzene,1-nitro-4-(phenylmethyl) structure
|
Common Name | Benzene,1-nitro-4-(phenylmethyl) | ||
|---|---|---|---|---|
| CAS Number | 1817-77-2 | Molecular Weight | 213.23200 | |
| Density | 1.18g/cm3 | Boiling Point | 351.9ºC at 760mmHg | |
| Molecular Formula | C13H11NO2 | Melting Point | N/A | |
| MSDS | Chinese USA | Flash Point | 164.3ºC | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 1-benzyl-4-nitrobenzene |
|---|---|
| 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 | 1.18g/cm3 |
|---|---|
| Boiling Point | 351.9ºC at 760mmHg |
| Molecular Formula | C13H11NO2 |
| Molecular Weight | 213.23200 |
| Flash Point | 164.3ºC |
| Exact Mass | 213.07900 |
| PSA | 45.82000 |
| LogP | 3.70880 |
| Vapour Pressure | 8.06E-05mmHg at 25°C |
| Index of Refraction | n20/D 1.6040(lit.) |
| InChIKey | IDSGFSCSMXRJON-UHFFFAOYSA-N |
| SMILES | O=[N+]([O-])c1ccc(Cc2ccccc2)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 | H317 |
| Precautionary Statements | P280 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xi: Irritant; |
| Risk Phrases | 43 |
| Safety Phrases | 36/37 |
| RIDADR | NONH for all modes of transport |
| HS Code | 2904209090 |
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 8 | |
CAS#:100-11-8
CAS#:98-80-6
CAS#:33091-15-5
CAS#:100-14-1
CAS#:1144-74-7
CAS#:960-16-7
CAS#:70207-45-3
CAS#:619-73-8
CAS#:71-43-2
CAS#:2996-92-1
CAS#:1817-74-9
CAS#:1817-75-0
CAS#:1135-12-2
CAS#:1137-41-3
CAS#:101-53-1
CAS#:108-95-2
CAS#:62-23-7This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2904209090 |
|---|---|
| Summary | 2904209090 derivatives containing only nitro or only nitroso groups。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0% |
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.
| 1-benzyl-4-nitro-benzene |
| 4-NitrodiphenylMethane |
| 4-benzyl-1-nitrobenzene |
| 4-Nitro-diphenylmethane |
| MFCD00024783 |
| p-Nitrodiphenylmethane |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of 1-benzyl-4-nitrobenzene? |
| A: SMILES notation of 1-benzyl-4-nitrobenzene is O=[N+]([O-])c1ccc(Cc2ccccc2)cc1. |
| Q: What is the safety information for 1-benzyl-4-nitrobenzene? |
| A: Safety information for 1-benzyl-4-nitrobenzene: 36/37. |
| Q: What is the English name of 1-benzyl-4-nitrobenzene? |
| A: The English name of 1-benzyl-4-nitrobenzene is 1-benzyl-4-nitrobenzene. |
| Q: What is the polar surface area (PSA) of 1-benzyl-4-nitrobenzene? |
| A: Polar surface area (PSA) of 1-benzyl-4-nitrobenzene is 45.82000. |
| Q: What is the boiling point of 1-benzyl-4-nitrobenzene? |
| A: Boiling point of 1-benzyl-4-nitrobenzene is 351.9ºC at 760mmHg. |
| Q: What is the molecular formula of 1-benzyl-4-nitrobenzene? |
| A: Molecular formula of 1-benzyl-4-nitrobenzene is C13H11NO2. |
| Q: What are the upstream materials of 1-benzyl-4-nitrobenzene? |
| A: Related upstream materials(CAS) of 1-benzyl-4-nitrobenzene: 100-11-8;98-80-6;33091-15-5;100-14-1;1144-74-7;960-16-7;70207-45-3;619-73-8;71-43-2;2996-92-1. |
| Q: What is the InChIKey of 1-benzyl-4-nitrobenzene? |
| A: InChIKey of 1-benzyl-4-nitrobenzene is IDSGFSCSMXRJON-UHFFFAOYSA-N. |
| Q: What is the molecular weight of 1-benzyl-4-nitrobenzene? |
| A: Molecular weight of 1-benzyl-4-nitrobenzene is 213.23200. |
| Q: What is the CAS number of 1-benzyl-4-nitrobenzene? |
| A: CAS number of 1-benzyl-4-nitrobenzene is 1817-77-2. |
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. |