![1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]- structure](/static/products/924/924962-31-2.png)
1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]-
TL;DR: 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]- (CAS 924962-31-2) is a chemical compound with molecular formula C13H10BrNO2 and molecular weight 290.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-bromophenyl)iminomethyl]benzene-1,2-diol
Also Known As: benzyl 2-phenylethynyl sulfone, 3-(4-Bromophenyliminomethyl)-1,2-benzenediol, 3-(4-Bromophenyliminomethyl)benzene-1,2-diol, J1.127.485D, 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]-
| Molecular Formula | C13H10BrNO2 |
|---|---|
| Molecular Weight | 290.99 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 52.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 290.9895 |
| Heavy Atoms | 17 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 924962-31-2 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)O)O)C=NC2=CC=C(C=C2)Br |
| InChIKey | REDZRGGFOKZFIX-UHFFFAOYSA-N |
Product Overview
1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]- (CAS 924962-31-2), with molecular formula C13H10BrNO2 and molecular weight 290.99 g/mol. IUPAC: 3-[(4-bromophenyl)iminomethyl]benzene-1,2-diol.
Chemical Property Profile of 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]-
Property Insights of 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]-
The XLogP value of 3.4 indicates that 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.8 Ų, 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]- has 2 hydrogen bond donor(s) and 3 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 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]-?
The CAS number of 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]- is 924962-31-2.
What is the molecular formula of 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]-?
The molecular formula of 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]- is C13H10BrNO2.
What is the molecular weight of 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]-?
The molecular weight of 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]- is 290.99 g/mol.
Where can I buy 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]-?
You can request a quote for 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Benzenediol, 3-[(E)-((4-bromophenyl)imino)methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.