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1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride structure
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1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride

TL;DR: 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride (CAS 63981-47-5) is a chemical compound with molecular formula C10H21ClN2O2 and molecular weight 236.12915 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

ethyl 4-propylpiperazine-1-carboxylate;hydrochloride

Also Known As: 1-Carbethoxy-4-propylpiperazine hydrochloride, 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride, ethyl 4-propylpiperazine-1-carboxylate hydrochloride, ethyl 4-propylpiperazine-1-carboxylate hydrochloride(1:1), Ethyl 4-propylpiperazine-1-carboxylate--hydrogen chloride (1/1)

CAS Number
63981-47-5
Molecular Formula
C10H21ClN2O2
Molecular Weight
236.12915 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (12 patents) Pharmaceutical Intermediates (2 patents)

Technical Specifications

Molecular FormulaC10H21ClN2O2
Molecular Weight236.12915 g/mol
XLogP1.59
Topological Polar Surface Area (TPSA)32.8 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds4
Exact Mass236.12915 Da
Heavy Atoms15
Complexity177.0
SMILESCCCN1CCN(CC1)C(=O)OCC.Cl
InChIKeyWVLVCZVVOWSJHJ-UHFFFAOYSA-N

Chemical Property Profile of 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride

XLogP
1.59
TPSA (Topological Polar Surface Area)
32.8
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
4
Heavy Atoms
15
Complexity
177.0
Exact Mass
236.12915
Monoisotopic Mass
236.12915
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 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride

The XLogP value of 1.59 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride. With a topological polar surface area (TPSA) of 32.8 Ų, 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride has 1 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 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride?

The CAS number of 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride is 63981-47-5.

What is the molecular formula of 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride?

The molecular formula of 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride is C10H21ClN2O2.

What is the molecular weight of 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride?

The molecular weight of 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride is 236.12915 g/mol.

Where can I buy 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride?

You can request a quote for 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride?

Yes, CoreyChem provides custom synthesis services for 1-Piperazinecarboxylic acid, 4-propyl-, ethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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