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8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one
TL;DR: 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one (CAS 102076-10-8) is a chemical compound with molecular formula C16H21NO3 and molecular weight 275.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one
Also Known As: 8-(dimethylaminomethyl)-7-ethoxy-2,3-dimethylchromen-4-one, 8-(dimethylaminomethyl)-7-ethoxy-2,3-dimethyl-chromen-4-one, 8-[(dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one, 8-[(dimethylamino)methyl]-7-ethoxy-2,3-dimethyl-4h-chromen-4-one
| Molecular Formula | C16H21NO3 |
|---|---|
| Molecular Weight | 275.15 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.15213 |
| Heavy Atoms | 20 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 102076-10-8 |
|---|---|
| SMILES | CCOC1=C(C2=C(C=C1)C(=O)C(=C(O2)C)C)CN(C)C |
| InChIKey | QISHCBPOCYMVCQ-UHFFFAOYSA-N |
Product Overview
8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one (CAS 102076-10-8), with molecular formula C16H21NO3 and molecular weight 275.15 g/mol. IUPAC: 8-[(dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one.
Chemical Property Profile of 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one
Property Insights of 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one. With a topological polar surface area (TPSA) of 38.8 Ų, 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one 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 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one?
The CAS number of 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one is 102076-10-8.
What is the molecular formula of 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one?
The molecular formula of 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one is C16H21NO3.
What is the molecular weight of 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one?
The molecular weight of 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one is 275.15 g/mol.
Where can I buy 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one?
You can request a quote for 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 8-[(Dimethylamino)methyl]-7-ethoxy-2,3-dimethylchromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.