Acetic acid, iodo-, diester with meso-2,3-butanediol
TL;DR: Acetic acid, iodo-, diester with meso-2,3-butanediol (CAS 6305-45-9) is a chemical compound with molecular formula C8H12I2O4 and molecular weight 425.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S)-3-(2-iodoacetyl)oxybutan-2-yl] 2-iodoacetate
Also Known As: meso-2,3-Butanediol-bis(iodoacetate), S 72, ACETIC ACID, IODO-, DIESTER with meso-2,3-BUTANEDIOL, S-72, (2R,3S)-Butane-2,3-diyl bis(iodoacetate)
| Molecular Formula | C8H12I2O4 |
|---|---|
| Molecular Weight | 425.88 g/mol |
| LogP | 1.7198 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 425.8825 |
| Heavy Atoms | 14 |
| Complexity | 185.51796 |
Chemical Identifiers
| CAS Number | 6305-45-9 |
|---|---|
| SMILES | C[C@H]([C@H](C)OC(=O)CI)OC(=O)CI |
Product Overview
Acetic acid, iodo-, diester with meso-2,3-butanediol (CAS 6305-45-9), with molecular formula C8H12I2O4 and molecular weight 425.88 g/mol. IUPAC: [(2R,3S)-3-(2-iodoacetyl)oxybutan-2-yl] 2-iodoacetate.
Chemical Property Profile of Acetic acid, iodo-, diester with meso-2,3-butanediol
Property Insights of Acetic acid, iodo-, diester with meso-2,3-butanediol
The XLogP value of 1.7198 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, iodo-, diester with meso-2,3-butanediol. With a topological polar surface area (TPSA) of 52.6 Ų, Acetic acid, iodo-, diester with meso-2,3-butanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, iodo-, diester with meso-2,3-butanediol has 0 hydrogen bond donor(s) and 4 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 Acetic acid, iodo-, diester with meso-2,3-butanediol?
The CAS number of Acetic acid, iodo-, diester with meso-2,3-butanediol is 6305-45-9.
What is the molecular formula of Acetic acid, iodo-, diester with meso-2,3-butanediol?
The molecular formula of Acetic acid, iodo-, diester with meso-2,3-butanediol is C8H12I2O4.
What is the molecular weight of Acetic acid, iodo-, diester with meso-2,3-butanediol?
The molecular weight of Acetic acid, iodo-, diester with meso-2,3-butanediol is 425.88 g/mol.
Where can I buy Acetic acid, iodo-, diester with meso-2,3-butanediol?
You can request a quote for Acetic acid, iodo-, diester with meso-2,3-butanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, iodo-, diester with meso-2,3-butanediol?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, iodo-, diester with meso-2,3-butanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.