Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride
TL;DR: Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride (CAS 24503-25-1) is a chemical compound with molecular formula C10H14ClN3O2 and molecular weight 243.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diaminomethylidene-(4-ethoxycarbonylphenyl)azanium chloride
Also Known As: p-Carbethoxyphenyl guanidine hydrochloride, p-Guanidinobenzoic acid ethyl ester hydrochloride, BENZOIC ACID, p-GUANIDINO-, ETHYL ESTER, MONOHYDROCHLORIDE, diaminomethylidene-(4-ethoxycarbonylphenyl)azanium chloride, Benzoic acid,4-[(aminoiminomethyl)amino]-, ethyl ester, hydrochloride (1:1)
| Molecular Formula | C10H14ClN3O2 |
|---|---|
| Molecular Weight | 243.08 g/mol |
| LogP | -4.15 |
| Topological Polar Surface Area | 92.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 243.07745 |
| Heavy Atoms | 16 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 24503-25-1 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)[NH+]=C(N)N.[Cl-] |
| InChIKey | JVKHTQOESNXCQB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride (CAS 24503-25-1), with molecular formula C10H14ClN3O2 and molecular weight 243.08 g/mol. IUPAC: diaminomethylidene-(4-ethoxycarbonylphenyl)azanium chloride.
Chemical Property Profile of Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride
Property Insights of Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride
The XLogP value of -4.15 indicates that Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride. Following Lipinski's Rule of Five, Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride?
The CAS number of Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride is 24503-25-1.
What is the molecular formula of Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride?
The molecular formula of Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride is C10H14ClN3O2.
What is the molecular weight of Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride?
The molecular weight of Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride is 243.08 g/mol.
Where can I buy Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride?
You can request a quote for Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, p-guanidino-, ethyl ester, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.