6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈
TL;DR: 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈 (CAS 57543-75-6) is a chemical compound with molecular formula C12H11NO2 and molecular weight 201.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈
6-methoxy-2-methyl-2H-chromene-3-carbonitrile
Also Known As: 6-Methoxy-2-methyl-2H-1-benzopyran-3-carbonitrile, 6-methoxy-2-methyl-2H-chromene-3-carbonitrile, 5-18-07-00380 (Beilstein Handbook Reference), 2H-1-BENZOPYRAN-3-CARBONITRILE, 6-METHOXY-2-METHYL-, 2H-1-BENZOPYRAN-3-CARBONITRILE,6-METHOXY-2-METHYL
| Molecular Formula | C12H11NO2 |
|---|---|
| Molecular Weight | 201.08 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 42.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.07898 |
| Heavy Atoms | 15 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 57543-75-6 |
|---|---|
| SMILES | CC1C(=CC2=C(O1)C=CC(=C2)OC)C#N |
| InChIKey | UUSZDXMVPFHPTG-UHFFFAOYSA-N |
Product Overview
6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈 (CAS 57543-75-6), with molecular formula C12H11NO2 and molecular weight 201.08 g/mol. IUPAC: 6-methoxy-2-methyl-2H-chromene-3-carbonitrile.
Chemical Property Profile of 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈
Property Insights of 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈. With a topological polar surface area (TPSA) of 42.3 Ų, 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈 has 0 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 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈?
The CAS number of 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈 is 57543-75-6.
What is the molecular formula of 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈?
The molecular formula of 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈 is C12H11NO2.
What is the molecular weight of 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈?
The molecular weight of 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈 is 201.08 g/mol.
Where can I buy 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈?
You can request a quote for 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈?
Yes, KEHONG BIO provides custom synthesis services for 6-甲氧基-2-甲基-2H-1-苯并吡喃-3-甲腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.