4-bromoaniline-2,3,5,6-d4
4-bromoaniline-2,3,5,6-d4 structure
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Common Name | 4-bromoaniline-2,3,5,6-d4 | ||
|---|---|---|---|---|
| CAS Number | 61357-76-4 | Molecular Weight | 176.04700 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C6H2BrD4N | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: 4-Bromoaniline-2,3,5,6-d4, Chinese name unknown, CAS number 61357-76-4, molecular formula C6H2BrD4N, molecular weight 176.04700, for research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-bromoaniline-2,3,5,6-d4 |
|---|---|
| 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.
| Molecular Formula | C6H2BrD4N |
|---|---|
| Molecular Weight | 176.04700 |
| Exact Mass | 174.99300 |
| PSA | 26.02000 |
| LogP | 2.61250 |
| InChIKey | WDFQBORIUYODSI-RHQRLBAQSA-N |
| SMILES | Nc1ccc(Br)cc1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~59%
4-bromoaniline-... CAS#:61357-76-4 |
| Literature: CONCERT PHARMACEUTICALS INC.; TUNG, Roger; MASSE, Craig, E. Patent: WO2011/103457 A1, 2011 ; Location in patent: Page/Page column 31; 32 ; |
|
~50%
4-bromoaniline-... CAS#:61357-76-4 |
| Literature: Derdau, Volker; Atzrodt, Jens; Zimmermann, Jochen; Kroll, Carsten; Brueckner, Francois Chemistry - A European Journal, 2009 , vol. 15, # 40 p. 10397 - 10404 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
|---|---|
| DownStream 0 | |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 4-bromo-2,2-dimethyl-pent-4-enal |
| 4-bromo-2,3,5,6-tetradeuterio-aniline |
| 1-bromo-2,3,5,6-tetradeuterio-4-methyl-benzene |
| 4-Pentenal,4-bromo-2,2-dimethyl |
| 4-bromo-2,3,5,6-tetradeuteroaniline |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of 4-bromoaniline-2,3,5,6-d4? |
| A: Molecular weight of 4-bromoaniline-2,3,5,6-d4 is 176.04700. |
| Q: What is the SMILES notation of 4-bromoaniline-2,3,5,6-d4? |
| A: SMILES notation of 4-bromoaniline-2,3,5,6-d4 is Nc1ccc(Br)cc1. |
| Q: What are the upstream materials of 4-bromoaniline-2,3,5,6-d4? |
| A: Related upstream materials(CAS) of 4-bromoaniline-2,3,5,6-d4: 4165-61-1;106-40-1. |
| Q: What is the LogP of 4-bromoaniline-2,3,5,6-d4? |
| A: LogP of 4-bromoaniline-2,3,5,6-d4 is 2.61250. |
| Q: What is the InChIKey of 4-bromoaniline-2,3,5,6-d4? |
| A: InChIKey of 4-bromoaniline-2,3,5,6-d4 is WDFQBORIUYODSI-RHQRLBAQSA-N. |
| Q: What is the Chinese name of 61357-76-4? |
| A: Chinese name of 61357-76-4 is 61357-76-4. |
| Q: What is the molecular formula of 4-bromoaniline-2,3,5,6-d4? |
| A: Molecular formula of 4-bromoaniline-2,3,5,6-d4 is C6H2BrD4N. |
| Q: What is the English name of 4-bromoaniline-2,3,5,6-d4? |
| A: The English name of 4-bromoaniline-2,3,5,6-d4 is 4-bromoaniline-2,3,5,6-d4. |
| Q: What is the CAS number of 4-bromoaniline-2,3,5,6-d4? |
| A: CAS number of 4-bromoaniline-2,3,5,6-d4 is 61357-76-4. |
| Q: What English synonyms does 4-bromoaniline-2,3,5,6-d4 have? |
| A: English synonyms of 4-bromoaniline-2,3,5,6-d4: 4-bromo-2,2-dimethyl-pent-4-enal, 4-bromo-2,3,5,6-tetradeuterio-aniline, 1-bromo-2,3,5,6-tetradeuterio-4-methyl-benzene, 4-Pentenal,4-bromo-2,2-dimethyl, 4-bromo-2,3,5,6-tetradeuteroaniline. |