RefChem:1090473
TL;DR: RefChem:1090473 (CAS 70070-10-9) is a chemical compound with molecular formula C16H26ClNO3 and molecular weight 315.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)-diethyl-methylazanium chloride
Also Known As: 1H-2-Benzopyran-1-methanamine, N,N-diethyl-3,4-dihydro-6,7-dimethoxy-, hydrochloride, N,N-Diethyl-3,4-dihydro-6,7-dimethoxy-1H-2-benzopyran-1-methanamine hydrochloride, N,N-Diethyl-6,7-dimethoxy-N-methyl-3,4-dihydro-1H-2-benzopyran-1-aminium chloride, (6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)-diethyl-methylazanium chloride, RefChem:1090473
| Molecular Formula | C16H26ClNO3 |
|---|---|
| Molecular Weight | 315.16 g/mol |
| LogP | -0.23 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.16013 |
| Heavy Atoms | 21 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 70070-10-9 |
|---|---|
| SMILES | CC[N+](C)(CC)C1C2=CC(=C(C=C2CCO1)OC)OC.[Cl-] |
| InChIKey | IXUGEDCXRIBDPY-UHFFFAOYSA-M |
Product Overview
RefChem:1090473 (CAS 70070-10-9), with molecular formula C16H26ClNO3 and molecular weight 315.16 g/mol. IUPAC: (6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)-diethyl-methylazanium chloride.
Chemical Property Profile of RefChem:1090473
Property Insights of RefChem:1090473
The XLogP value of -0.23 indicates that RefChem:1090473 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 27.7 Ų, RefChem:1090473 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1090473 has 0 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 RefChem:1090473?
The CAS number of RefChem:1090473 is 70070-10-9.
What is the molecular formula of RefChem:1090473?
The molecular formula of RefChem:1090473 is C16H26ClNO3.
What is the molecular weight of RefChem:1090473?
The molecular weight of RefChem:1090473 is 315.16 g/mol.
Where can I buy RefChem:1090473?
You can request a quote for RefChem:1090473 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1090473?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1090473 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.