![N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine structure](/static/products/6541/65417-74-5.webp)
N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine
TL;DR: N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine (CAS 65417-74-5) is a chemical compound with molecular formula C8H6BrNO3 and molecular weight 242.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine
Also Known As: Bionet2_000416, NCI60_016415, 6-Bromo-1,3-benzodioxole-5-carbaldehyde oxime, N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine
| Molecular Formula | C8H6BrNO3 |
|---|---|
| Molecular Weight | 242.95 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 242.95311 |
| Heavy Atoms | 13 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 65417-74-5 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)C=NO)Br |
| InChIKey | LDVWAWRHAYQDDA-UHFFFAOYSA-N |
Product Overview
N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine (CAS 65417-74-5), with molecular formula C8H6BrNO3 and molecular weight 242.95 g/mol. IUPAC: N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine.
Chemical Property Profile of N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine
Property Insights of N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine. With a topological polar surface area (TPSA) of 51.1 Ų, N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine?
The CAS number of N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine is 65417-74-5.
What is the molecular formula of N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine?
The molecular formula of N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine is C8H6BrNO3.
What is the molecular weight of N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine?
The molecular weight of N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine is 242.95 g/mol.
Where can I buy N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine?
You can request a quote for N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine?
Yes, KEHONG BIO provides custom synthesis services for N-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydroxylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.