(S,r)-1-phenyl-1,2-propanediol
TL;DR: (S,r)-1-phenyl-1,2-propanediol (CAS 40560-98-3) is a chemical compound with molecular formula C9H12O2 and molecular weight 152.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R)-1-phenylpropane-1,2-diol
Also Known As: erythro-1-Phenylpropane-1,2-diol, (S,r)-1-phenyl-1,2-propanediol, EINECS 217-452-1, (1s,2r)-1-phenylpropane-1,2-diol, erythro-1-Phenyl-1,2-dihydroxypropan
| Molecular Formula | C9H12O2 |
|---|---|
| Molecular Weight | 152.08 g/mol |
| LogP | 1.1008 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.08372 |
| Heavy Atoms | 11 |
| Complexity | 206.06253 |
Chemical Identifiers
| CAS Number | 40560-98-3 |
|---|---|
| SMILES | C[C@H]([C@H](C1=CC=CC=C1)O)O |
Product Overview
(S,r)-1-phenyl-1,2-propanediol (CAS 40560-98-3), with molecular formula C9H12O2 and molecular weight 152.08 g/mol. IUPAC: (1S,2R)-1-phenylpropane-1,2-diol.
Chemical Property Profile of (S,r)-1-phenyl-1,2-propanediol
Property Insights of (S,r)-1-phenyl-1,2-propanediol
The XLogP value of 1.1008 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S,r)-1-phenyl-1,2-propanediol. With a topological polar surface area (TPSA) of 40.46 Ų, (S,r)-1-phenyl-1,2-propanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S,r)-1-phenyl-1,2-propanediol has 2 hydrogen bond donor(s) and 2 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,r)-1-phenyl-1,2-propanediol?
The CAS number of (S,r)-1-phenyl-1,2-propanediol is 40560-98-3.
What is the molecular formula of (S,r)-1-phenyl-1,2-propanediol?
The molecular formula of (S,r)-1-phenyl-1,2-propanediol is C9H12O2.
What is the molecular weight of (S,r)-1-phenyl-1,2-propanediol?
The molecular weight of (S,r)-1-phenyl-1,2-propanediol is 152.08 g/mol.
Where can I buy (S,r)-1-phenyl-1,2-propanediol?
You can request a quote for (S,r)-1-phenyl-1,2-propanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S,r)-1-phenyl-1,2-propanediol?
Yes, KEHONG BIO provides custom synthesis services for (S,r)-1-phenyl-1,2-propanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.