Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester
TL;DR: Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester (CAS 59902-29-3) is a chemical compound with molecular formula C16H20O5 and molecular weight 292.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dioxaspiro[4.5]decan-3-ylmethyl 2-hydroxybenzoate
Also Known As: 1,4-Dioxaspiro(4.5)dec-2-ylmethyl 2-hydroxybenzoate, (1,4-Dioxaspiro(4.5)dec-2-yl)methyl o-hydroxybenzoate, o-Hydroxybenzoic acid (1,4-dioxaspiro(4.5)dec-2-yl)methyl ester, Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester, 1,4-dioxaspiro[4.5]decan-3-ylmethyl 2-hydroxybenzoate
| Molecular Formula | C16H20O5 |
|---|---|
| Molecular Weight | 292.13 g/mol |
| LogP | 2.6248 |
| Topological Polar Surface Area | 64.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.13107 |
| Heavy Atoms | 21 |
| Complexity | 507.14374 |
Chemical Identifiers
| CAS Number | 59902-29-3 |
|---|---|
| SMILES | C1CCC2(CC1)OCC(O2)COC(=O)C3=CC=CC=C3O |
Product Overview
Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester (CAS 59902-29-3), with molecular formula C16H20O5 and molecular weight 292.13 g/mol. IUPAC: 1,4-dioxaspiro[4.5]decan-3-ylmethyl 2-hydroxybenzoate.
Chemical Property Profile of Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester
Property Insights of Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester
The XLogP value of 2.6248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester. The TPSA of 64.99 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester. Following Lipinski's Rule of Five, Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester has 1 hydrogen bond donor(s) and 5 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, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester?
The CAS number of Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester is 59902-29-3.
What is the molecular formula of Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester?
The molecular formula of Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester is C16H20O5.
What is the molecular weight of Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester?
The molecular weight of Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester is 292.13 g/mol.
Where can I buy Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester?
You can request a quote for Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-hydroxy-, 1,4-dioxaspiro(4.5)dec-2-ylmethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.