Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1)
TL;DR: Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1) (CAS 78265-97-1) is a chemical compound with molecular formula C18H30ClNO2 and molecular weight 327.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-decoxy-2-oxo-1-phenylethyl)azanium chloride
Also Known As: D,L-2-Phenylglycinedecylesterhydrochlorid, D,L-2-Phenylglycinedecylesterhydrochlorid [German], (2-decoxy-2-oxo-1-phenylethyl)azanium chloride, GLYCINE, 2-PHENYL-, DECYL ESTER, HYDROCHLORIDE, D,L-, Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride, (+-)-
| Molecular Formula | C18H30ClNO2 |
|---|---|
| Molecular Weight | 327.20 g/mol |
| LogP | 0.66 |
| Topological Polar Surface Area | 53.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 327.1965 |
| Heavy Atoms | 22 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 78265-97-1 |
|---|---|
| SMILES | CCCCCCCCCCOC(=O)C(C1=CC=CC=C1)[NH3+].[Cl-] |
| InChIKey | XUGRTMBNSJFIEP-UHFFFAOYSA-N |
Product Overview
Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1) (CAS 78265-97-1), with molecular formula C18H30ClNO2 and molecular weight 327.20 g/mol. IUPAC: (2-decoxy-2-oxo-1-phenylethyl)azanium chloride.
Chemical Property Profile of Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1)
Property Insights of Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1)
The XLogP value of 0.66 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1). With a topological polar surface area (TPSA) of 53.9 Ų, Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1) 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
Frequently Asked Questions
What is the CAS number of Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1)?
The CAS number of Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1) is 78265-97-1.
What is the molecular formula of Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1)?
The molecular formula of Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1) is C18H30ClNO2.
What is the molecular weight of Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1)?
The molecular weight of Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1) is 327.20 g/mol.
Where can I buy Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1)?
You can request a quote for Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzeneacetic acid, alpha-amino-, decyl ester, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.