6-(二氟膦酰甲基)萘-2-甲酸
TL;DR: 6-(二氟膦酰甲基)萘-2-甲酸 (CAS 219316-39-9) is a chemical compound with molecular formula C12H9F2O5P and molecular weight 302.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(二氟膦酰甲基)萘-2-甲酸
6-[difluoro(phosphono)methyl]naphthalene-2-carboxylic acid
Also Known As: 1bzj, 6-(difluoro-phosphono-methyl)-naphthalene-2-carboxylic acid, 6-[difluoro(phosphono)methyl]naphthalene-2-carboxylic acid, 6-(phosphonodifluoromethyl)-2-naphthoic acid, J1.061.251I
| Molecular Formula | C12H9F2O5P |
|---|---|
| Molecular Weight | 302.02 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.01556 |
| Heavy Atoms | 20 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 219316-39-9 |
|---|---|
| SMILES | C1=CC2=C(C=CC(=C2)C(F)(F)P(=O)(O)O)C=C1C(=O)O |
| InChIKey | NKGNOWNPXBURRW-UHFFFAOYSA-N |
Product Overview
6-(二氟膦酰甲基)萘-2-甲酸 (CAS 219316-39-9), with molecular formula C12H9F2O5P and molecular weight 302.02 g/mol. IUPAC: 6-[difluoro(phosphono)methyl]naphthalene-2-carboxylic acid.
Chemical Property Profile of 6-(二氟膦酰甲基)萘-2-甲酸
Property Insights of 6-(二氟膦酰甲基)萘-2-甲酸
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(二氟膦酰甲基)萘-2-甲酸. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(二氟膦酰甲基)萘-2-甲酸. Following Lipinski's Rule of Five, 6-(二氟膦酰甲基)萘-2-甲酸 has 3 hydrogen bond donor(s) and 7 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-(二氟膦酰甲基)萘-2-甲酸?
The CAS number of 6-(二氟膦酰甲基)萘-2-甲酸 is 219316-39-9.
What is the molecular formula of 6-(二氟膦酰甲基)萘-2-甲酸?
The molecular formula of 6-(二氟膦酰甲基)萘-2-甲酸 is C12H9F2O5P.
What is the molecular weight of 6-(二氟膦酰甲基)萘-2-甲酸?
The molecular weight of 6-(二氟膦酰甲基)萘-2-甲酸 is 302.02 g/mol.
Where can I buy 6-(二氟膦酰甲基)萘-2-甲酸?
You can request a quote for 6-(二氟膦酰甲基)萘-2-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(二氟膦酰甲基)萘-2-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 6-(二氟膦酰甲基)萘-2-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.