N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine
TL;DR: N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine (CAS 736088-07-6) is a chemical compound with molecular formula C11H16N2O and molecular weight 192.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(oxolan-2-ylmethyl)benzene-1,4-diamine
Also Known As: 4-N-(oxolan-2-ylmethyl)benzene-1,4-diamine, N-(Tetrahydro-furan-2-ylmethyl)-benzene-1,4-diamine, N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine, 1,4-benzenediamine, N1-[(tetrahydro-2-furanyl)methyl]-
| Molecular Formula | C11H16N2O |
|---|---|
| Molecular Weight | 192.13 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 47.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.12627 |
| Heavy Atoms | 14 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 736088-07-6 |
|---|---|
| SMILES | C1CC(OC1)CNC2=CC=C(C=C2)N |
| InChIKey | WPYPITRUPFKTLT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine (CAS 736088-07-6), with molecular formula C11H16N2O and molecular weight 192.13 g/mol. IUPAC: 4-N-(oxolan-2-ylmethyl)benzene-1,4-diamine.
Chemical Property Profile of N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine
Property Insights of N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine. With a topological polar surface area (TPSA) of 47.3 Ų, N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine 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 N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine?
The CAS number of N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine is 736088-07-6.
What is the molecular formula of N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine?
The molecular formula of N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine is C11H16N2O.
What is the molecular weight of N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine?
The molecular weight of N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine is 192.13 g/mol.
Where can I buy N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine?
You can request a quote for N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for N1-((Tetrahydrofuran-2-yl)methyl)benzene-1,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.