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(3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid structure
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(3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid

TL;DR: (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid (CAS 1366510-66-8) is a chemical compound with molecular formula C16H23NO5 and molecular weight 309.15762 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(3S)-3-(4-ethoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Also Known As: (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid, 3-(4-ethoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic Acid, (3S)-3-(4-ethoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

CAS Number
1366510-66-8
Molecular Formula
C16H23NO5
Molecular Weight
309.15762 g/mol
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Technical Specifications

Molecular FormulaC16H23NO5
Molecular Weight309.15762 g/mol
XLogP2.3
Topological Polar Surface Area (TPSA)84.9 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds8
Exact Mass309.15762 Da
Heavy Atoms22
Complexity369.0
SMILESCCOC1=CC=C(C=C1)[C@H](CC(=O)O)NC(=O)OC(C)(C)C
InChIKeyZPTLOCLQIAZRFR-ZDUSSCGKSA-N

Chemical Property Profile of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid

XLogP
2.3
TPSA (Topological Polar Surface Area)
84.9
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
8
Heavy Atoms
22
Complexity
369.0
Exact Mass
309.15762
Monoisotopic Mass
309.15762
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 (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid

The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid. Following Lipinski's Rule of Five, (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid has 2 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 (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid?

The CAS number of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid is 1366510-66-8.

What is the molecular formula of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid?

The molecular formula of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid is C16H23NO5.

What is the molecular weight of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid?

The molecular weight of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid is 309.15762 g/mol.

Where can I buy (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid?

You can request a quote for (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid?

Yes, CoreyChem provides custom synthesis services for (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(4-ethoxyphenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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