(S)-4-Benzyloxy-1,2-butanediol
TL;DR: (S)-4-Benzyloxy-1,2-butanediol (CAS 86990-91-2) is a chemical compound with molecular formula C11H16O3 and molecular weight 196.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-4-phenylmethoxybutane-1,2-diol
Also Known As: (S)-4-Benzyloxy-1,2-butanediol, (S)-4-(Benzyloxy)butane-1,2-diol, (2S)-4-phenylmethoxybutane-1,2-diol, 4-phenylmethoxybutane-1,2-diol, (R)-4-Benzyloxy-1,2-butanediol
| Molecular Formula | C11H16O3 |
|---|---|
| Molecular Weight | 196.11 g/mol |
| LogP | 0.9465 |
| Topological Polar Surface Area | 49.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 196.10994 |
| Heavy Atoms | 14 |
| Complexity | 235.54778 |
Chemical Identifiers
| CAS Number | 86990-91-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COCC[C@@H](CO)O |
Product Overview
(S)-4-Benzyloxy-1,2-butanediol (CAS 86990-91-2), with molecular formula C11H16O3 and molecular weight 196.11 g/mol. IUPAC: (2S)-4-phenylmethoxybutane-1,2-diol.
Chemical Property Profile of (S)-4-Benzyloxy-1,2-butanediol
Property Insights of (S)-4-Benzyloxy-1,2-butanediol
The XLogP value of 0.9465 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-4-Benzyloxy-1,2-butanediol. With a topological polar surface area (TPSA) of 49.69 Ų, (S)-4-Benzyloxy-1,2-butanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-4-Benzyloxy-1,2-butanediol has 2 hydrogen bond donor(s) and 3 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 (S)-4-Benzyloxy-1,2-butanediol?
The CAS number of (S)-4-Benzyloxy-1,2-butanediol is 86990-91-2.
What is the molecular formula of (S)-4-Benzyloxy-1,2-butanediol?
The molecular formula of (S)-4-Benzyloxy-1,2-butanediol is C11H16O3.
What is the molecular weight of (S)-4-Benzyloxy-1,2-butanediol?
The molecular weight of (S)-4-Benzyloxy-1,2-butanediol is 196.11 g/mol.
Where can I buy (S)-4-Benzyloxy-1,2-butanediol?
You can request a quote for (S)-4-Benzyloxy-1,2-butanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-4-Benzyloxy-1,2-butanediol?
Yes, KEHONG BIO provides custom synthesis services for (S)-4-Benzyloxy-1,2-butanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.