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guaifenesin beta-isomer structure
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guaifenesin beta-isomer

TL;DR: guaifenesin beta-isomer (CAS 14007-09-1) is a chemical compound with molecular formula C10H14O4 and molecular weight 198.0892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(2-methoxyphenoxy)propane-1,3-diol

Also Known As: 2-(2-methoxyphenoxy)propane-1,3-diol, Guaifenesin EP Impurity B, Guaifenesin Impurity B, Guaifenesin beta-isomer, starbld0045810

CAS Number
14007-09-1
Molecular Formula
C10H14O4
Molecular Weight
198.0892 g/mol
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Technical Specifications

Molecular FormulaC10H14O4
Molecular Weight198.0892 g/mol
XLogP0.3
Topological Polar Surface Area (TPSA)58.9 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds5
Exact Mass198.0892 Da
Heavy Atoms14
Complexity147.0
SMILESCOC1=CC=CC=C1OC(CO)CO
InChIKeyDTADPBLDQSWASV-UHFFFAOYSA-N

Chemical Property Profile of guaifenesin beta-isomer

XLogP
0.3
TPSA (Topological Polar Surface Area)
58.9
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
5
Heavy Atoms
14
Complexity
147.0
Exact Mass
198.0892
Monoisotopic Mass
198.0892
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 guaifenesin beta-isomer

The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for guaifenesin beta-isomer. With a topological polar surface area (TPSA) of 58.9 Ų, guaifenesin beta-isomer exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, guaifenesin beta-isomer has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of guaifenesin beta-isomer?

The CAS number of guaifenesin beta-isomer is 14007-09-1.

What is the molecular formula of guaifenesin beta-isomer?

The molecular formula of guaifenesin beta-isomer is C10H14O4.

What is the molecular weight of guaifenesin beta-isomer?

The molecular weight of guaifenesin beta-isomer is 198.0892 g/mol.

Where can I buy guaifenesin beta-isomer?

You can request a quote for guaifenesin beta-isomer directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for guaifenesin beta-isomer?

Yes, CoreyChem provides custom synthesis services for guaifenesin beta-isomer and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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