About 1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide
1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide (PubChem CID 175005473) has the molecular formula C7H10BrClN2O
and a molecular weight of 253.53 g/mol. Its IUPAC name is 1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide.
Molecular Properties
| Compound Name | 1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide |
| PubChem CID | 175005473 |
| Molecular Formula | C7H10BrClN2O |
| Molecular Weight | 253.53 g/mol |
| Exact Mass | 251.97 |
| IUPAC Name | 1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide |
| SMILES | Br.COc1ccc(NNCl)cc1 |
| InChI | InChI=1S/C7H9ClN2O.BrH/c1-11-7-4-2-6(3-5-7)9-10-8;/h2-5,9-10H,1H3;1H |
| InChIKey | GMPGWTAJCZPQKN-UHFFFAOYSA-N |
| XLogP | 2.34 |
| TPSA | 33.29 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 253.53 |
| LogP ≤ 5 | 2.34 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'N-halo', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide?
The IUPAC name of 1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide (CID 175005473) is 1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide.
What is the SMILES notation for 1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide?
The canonical SMILES for 1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide is Br.COc1ccc(NNCl)cc1.
What is the InChIKey of 1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide?
The InChIKey is GMPGWTAJCZPQKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClN2O.BrH/c1-11-7-4-2-6(3-5-7)9-10-8;/h2-5,9-10H,1H3;1H.
What are the key properties of 1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide?
1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide has a molecular weight of 253.53 g/mol, XLogP of 2.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide is sourced from PubChem (CID 175005473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).