![((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol structure](/static/products/785/78513-07-2.png)
((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol
TL;DR: ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol (CAS 78513-07-2) is a chemical compound with molecular formula C11H14O3 and molecular weight 194.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3R)-3-(phenylmethoxymethyl)oxiran-2-yl]methanol
Also Known As: [(2S,3R)-3-[(benzyloxy)methyl]oxiran-2-yl]methanol|(2S,3R)-2,3-Epoxy-4-benzyloxybutane-1-ol|(2S-cis)-3-(Benzyloxymethyl)oxirane methanol|3beta-(Benzyloxymethyl)oxirane-2beta-methanol|(2S,3R)-2,3-Epoxy-4-(benzyloxy)-1-butanol|(2S,3R)-4-(Benzyloxy)-2,3-epoxy-1-butanol|3beta-[(Benzyloxy)methyl]oxirane-2beta-methanol|(2S)-3beta-(Benzyloxymethyl)oxirane-2beta-methanol|(2S,3R)-3-[(Benzyloxy)methyl]oxirane-2-methanol|((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol|(2R)-2alpha-(Benzyloxymethyl)-3alpha-(hydroxymethyl)oxirane|KSQBAPLQXNCSOC-WDEREUQCSA-N
| Molecular Formula | C11H14O3 |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | 0.9629 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 194.0943 |
| Heavy Atoms | 14 |
| Complexity | 273.12094 |
Chemical Identifiers
| CAS Number | 78513-07-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC[C@@H]2[C@@H](O2)CO |
Product Overview
((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol (CAS 78513-07-2), with molecular formula C11H14O3 and molecular weight 194.09 g/mol. IUPAC: [(2S,3R)-3-(phenylmethoxymethyl)oxiran-2-yl]methanol.
Chemical Property Profile of ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol
Property Insights of ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol
The XLogP value of 0.9629 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol. With a topological polar surface area (TPSA) of 41.99 Ų, ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol has 1 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 ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol?
The CAS number of ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol is 78513-07-2.
What is the molecular formula of ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol?
The molecular formula of ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol is C11H14O3.
What is the molecular weight of ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol?
The molecular weight of ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol is 194.09 g/mol.
Where can I buy ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol?
You can request a quote for ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol?
Yes, KEHONG BIO provides custom synthesis services for ((2S,3R)-3-{[(phenylmethyl)oxy]methyl}-2-oxiranyl)methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.