邻甲苯海拉明
TL;DR: 邻甲苯海拉明 (CAS 83-98-7) is a chemical compound with molecular formula C18H23NO and molecular weight 269.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
邻甲苯海拉明
N,N-dimethyl-2-[(2-methylphenyl)-phenylmethoxy]ethanamine
Also Known As: orphenadrine, Orphenadrin, Orphenadine, Orphenedrine, Disipal
| Molecular Formula | C18H23NO |
|---|---|
| Molecular Weight | 269.18 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 269.17798 |
| Heavy Atoms | 20 |
| Complexity | 260.0 |
| Melting Point | < 25 °C |
| Boiling Point | 195 |
| Solubility | Sparingly soluble in water |
Chemical Identifiers
| CAS Number | 83-98-7 |
|---|---|
| SMILES | CC1=CC=CC=C1C(C2=CC=CC=C2)OCCN(C)C |
| InChIKey | QVYRGXJJSLMXQH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
邻甲苯海拉明 (CAS 83-98-7), with molecular formula C18H23NO and molecular weight 269.18 g/mol. IUPAC: N,N-dimethyl-2-[(2-methylphenyl)-phenylmethoxy]ethanamine.
Chemical Property Profile of 邻甲苯海拉明
Property Insights of 邻甲苯海拉明
The XLogP value of 3.8 indicates that 奧菲那特林 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 邻甲苯海拉明 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 奧菲那特林 has 0 hydrogen bond donor(s) and 2 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 奧菲那特林?
The CAS number of 奧菲那特林 is 83-98-7.
What is the molecular formula of 奧菲那特林?
The molecular formula of 奧菲那特林 is C18H23NO.
What is the molecular weight of 奧菲那特林?
The molecular weight of 奧菲那特林 is 269.18 g/mol.
Where can I buy 奧菲那特林?
You can request a quote for 奧菲那特林 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 奧菲那特林?
Yes, KEHONG BIO provides custom synthesis services for 奧菲那特林 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.