[(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate
TL;DR: [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate (CAS 29781-91-7) is a chemical compound with molecular formula C15H17NO6 and molecular weight 307.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate
Also Known As: [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate|[(6E)-6-(Hydroxyimino)-2,2-dimethyltetrahydro-2H-furo[2,3-d][1,3]dioxol-5-yl]methyl benzoate|Benzoic acid 6-hydroxyimino-2,2-dimethyl-tetrahydro-furo[2,3-d][1,3]dioxol-5-ylmethyl ester
| Molecular Formula | C15H17NO6 |
|---|---|
| Molecular Weight | 307.11 g/mol |
| LogP | 1.55 |
| Topological Polar Surface Area | 86.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.1056 |
| Heavy Atoms | 22 |
| Complexity | 584.95526 |
Chemical Identifiers
| CAS Number | 29781-91-7 |
|---|---|
| SMILES | CC1(OC\2C(O1)OC(/C2=N\O)COC(=O)C3=CC=CC=C3)C |
Product Overview
[(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate (CAS 29781-91-7), with molecular formula C15H17NO6 and molecular weight 307.11 g/mol. IUPAC: [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate.
Chemical Property Profile of [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate
Property Insights of [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate
The XLogP value of 1.55 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate. The TPSA of 86.58 Ų falls within the moderate polarity range, balancing permeability and solubility for [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate. Following Lipinski's Rule of Five, [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate 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 [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate?
The CAS number of [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate is 29781-91-7.
What is the molecular formula of [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate?
The molecular formula of [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate is C15H17NO6.
What is the molecular weight of [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate?
The molecular weight of [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate is 307.11 g/mol.
Where can I buy [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate?
You can request a quote for [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate?
Yes, KEHONG BIO provides custom synthesis services for [(6E)-6-hydroxyimino-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.