Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)-
TL;DR: Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)- (CAS 105315-56-8) is a chemical compound with molecular formula C21H19NO8 and molecular weight 413.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]-2-oxoacetyl]oxybenzoic acid
Also Known As: Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)-, 3-[[(2,2-dimethyl-3H-benzofuran-7-yl)oxycarbonyl-methyl-carbamoyl]formyl]oxybenzoic Acid, 3-({[{[(2,2-Dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]carbonyl}(methyl)amino](oxo)acetyl}oxy)benzoic acid, 3-[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]-2-oxoacetyl]oxybenzoic acid, RefChem:327109
| Molecular Formula | C21H19NO8 |
|---|---|
| Molecular Weight | 413.11 g/mol |
| LogP | 2.6611 |
| Topological Polar Surface Area | 119.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 413.11105 |
| Heavy Atoms | 30 |
| Complexity | 1043.0519 |
Chemical Identifiers
| CAS Number | 105315-56-8 |
|---|---|
| SMILES | CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)C(=O)C(=O)OC3=CC=CC(=C3)C(=O)O)C |
Product Overview
Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)- (CAS 105315-56-8), with molecular formula C21H19NO8 and molecular weight 413.11 g/mol. IUPAC: 3-[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]-2-oxoacetyl]oxybenzoic acid.
Chemical Property Profile of Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)-
Property Insights of Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)-
The XLogP value of 2.6611 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)-. The TPSA of 119.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)-. Following Lipinski's Rule of Five, Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)- has 1 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 Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)-?
The CAS number of Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)- is 105315-56-8.
What is the molecular formula of Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)-?
The molecular formula of Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)- is C21H19NO8.
What is the molecular weight of Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)-?
The molecular weight of Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)- is 413.11 g/mol.
Where can I buy Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)-?
You can request a quote for Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3-((((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)oxoacetyl)oxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.