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3-Phenoxy-1,2-propanediol structure
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3-Phenoxy-1,2-propanediol

TL;DR: 3-Phenoxy-1,2-propanediol (CAS 538-43-2) is a chemical compound with molecular formula C9H12O3 and molecular weight 168.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-phenoxypropane-1,2-diol

Also Known As: 3-PHENOXY-1,2-PROPANEDIOL, 3-Phenoxypropane-1,2-diol, Antodyne, Antodyn, Phenylglyceryl ether

CAS Number
538-43-2
Molecular Formula
C9H12O3
Molecular Weight
168.07864 g/mol
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Application Areas

Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1 patents) Biotechnology (2 patents) Catalysts (3 patents) Coatings & Adhesives (86 patents) Dyes & Pigments (14 patents)

Technical Specifications

Molecular FormulaC9H12O3
Molecular Weight168.07864 g/mol
XLogP0.7
Topological Polar Surface Area (TPSA)49.7 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds4
Exact Mass168.07864 Da
Heavy Atoms12
Complexity110.0
Vapor Pressure0.00002 [mmHg]
SMILESC1=CC=C(C=C1)OCC(CO)O
InChIKeyFNQIYTUXOKTMDM-UHFFFAOYSA-N

Product Description

Applications: 3-Phenoxy-1,2-propanediol is used in polymer chemistry and functional materials synthesis, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 3-Phenoxy-1,2-propanediol (CAS 538-43-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A polymer intermediate supplied by CoreyChem, 3-Phenoxy-1,2-propanediol (CAS 538-43-2) has the molecular formula C9H12O3 and a molecular weight of 168.08 g/mol. It is also known as 3-PHENOXY-1,2-PROPANEDIOL and 3-Phenoxypropane-1,2-diol.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 3-Phenoxy-1,2-propanediol

XLogP
0.7
TPSA (Topological Polar Surface Area)
49.7
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
4
Heavy Atoms
12
Complexity
110.0
Exact Mass
168.07864
Monoisotopic Mass
168.07864
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 3-Phenoxy-1,2-propanediol

The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenoxy-1,2-propanediol. With a topological polar surface area (TPSA) of 49.7 Ų, 3-Phenoxy-1,2-propanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenoxy-1,2-propanediol 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

What is the CAS number of 3-Phenoxy-1,2-propanediol?

The CAS number of 3-Phenoxy-1,2-propanediol is 538-43-2.

What is the molecular formula of 3-Phenoxy-1,2-propanediol?

The molecular formula of 3-Phenoxy-1,2-propanediol is C9H12O3.

What is the molecular weight of 3-Phenoxy-1,2-propanediol?

The molecular weight of 3-Phenoxy-1,2-propanediol is 168.07864 g/mol.

What are the applications of 3-Phenoxy-1,2-propanediol?

3-Phenoxy-1,2-propanediol is used in polymer chemistry and functional materials synthesis, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 3-Phenoxy-1,2-propanediol...

Where can I buy 3-Phenoxy-1,2-propanediol?

You can request a quote for 3-Phenoxy-1,2-propanediol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-Phenoxy-1,2-propanediol?

Yes, CoreyChem provides custom synthesis services for 3-Phenoxy-1,2-propanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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