About 1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid
1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid (PubChem CID 175006375) has the molecular formula C7H11ClN2O5S
and a molecular weight of 270.69 g/mol. Its IUPAC name is 1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid.
Molecular Properties
| Compound Name | 1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid |
| PubChem CID | 175006375 |
| Molecular Formula | C7H11ClN2O5S |
| Molecular Weight | 270.69 g/mol |
| Exact Mass | 270.01 |
| IUPAC Name | 1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid |
| SMILES | COc1ccc(NNCl)cc1.O=S(=O)(O)O |
| InChI | InChI=1S/C7H9ClN2O.H2O4S/c1-11-7-4-2-6(3-5-7)9-10-8;1-5(2,3)4/h2-5,9-10H,1H3;(H2,1,2,3,4) |
| InChIKey | LUHMAGXJHZYTJQ-UHFFFAOYSA-N |
| XLogP | 1.11 |
| TPSA | 107.89 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 270.69 |
| LogP ≤ 5 | 1.11 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'N-halo', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid?
The IUPAC name of 1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid (CID 175006375) is 1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid.
What is the SMILES notation for 1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid?
The canonical SMILES for 1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid is COc1ccc(NNCl)cc1.O=S(=O)(O)O.
What is the InChIKey of 1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid?
The InChIKey is LUHMAGXJHZYTJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClN2O.H2O4S/c1-11-7-4-2-6(3-5-7)9-10-8;1-5(2,3)4/h2-5,9-10H,1H3;(H2,1,2,3,4).
What are the key properties of 1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid?
1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid has a molecular weight of 270.69 g/mol, XLogP of 1.11, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid is sourced from PubChem (CID 175006375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).