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Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate structure
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Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate

TL;DR: Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate (CAS 141099-44-7) is a chemical compound with molecular formula C17H21NO4 and molecular weight 303.14706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

methyl 3-cyano-3-(3-cyclopentyloxy-4-methoxyphenyl)propanoate

Also Known As: methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate, methyl 3-cyano-3-(3-cyclopentyloxy-4-methoxyphenyl)propanoate, 11M-702, methyl 3-cyano-3-(3-(cyclopentyloxy)-4-methoxyphenyl)propionate

CAS Number
141099-44-7
Molecular Formula
C17H21NO4
Molecular Weight
303.14706 g/mol
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Technical Specifications

Molecular FormulaC17H21NO4
Molecular Weight303.14706 g/mol
XLogP2.6
Topological Polar Surface Area (TPSA)68.6 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds7
Exact Mass303.14706 Da
Heavy Atoms22
Complexity410.0
SMILESCOC1=C(C=C(C=C1)C(CC(=O)OC)C#N)OC2CCCC2
InChIKeyBXPUWQRRZMYRCO-UHFFFAOYSA-N

Chemical Property Profile of Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate

XLogP
2.6
TPSA (Topological Polar Surface Area)
68.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
7
Heavy Atoms
22
Complexity
410.0
Exact Mass
303.14706
Monoisotopic Mass
303.14706
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 Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate

The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate. The TPSA of 68.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate. Following Lipinski's Rule of Five, Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate?

The CAS number of Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate is 141099-44-7.

What is the molecular formula of Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate?

The molecular formula of Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate is C17H21NO4.

What is the molecular weight of Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate?

The molecular weight of Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate is 303.14706 g/mol.

Where can I buy Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate?

You can request a quote for Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate?

Yes, CoreyChem provides custom synthesis services for Methyl 3-cyano-3-[3-(cyclopentyloxy)-4-methoxyphenyl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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