Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride
TL;DR: Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride (CAS 18855-04-4) is a chemical compound with molecular formula C13H22ClNO and molecular weight 243.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-hydroxy-1-phenylpropan-2-yl)-(2-methylpropyl)azanium chloride
Also Known As: alpha-(1-(Isobutylamino)ethyl)benzyl alcohol hydrochloride, BENZYL ALCOHOL, alpha-(1-(ISOBUTYLAMINO)ETHYL)-, HYDROCHLORIDE, (1-hydroxy-1-phenylpropan-2-yl)-(2-methylpropyl)azanium chloride
| Molecular Formula | C13H22ClNO |
|---|---|
| Molecular Weight | 243.14 g/mol |
| LogP | -1.67 |
| Topological Polar Surface Area | 36.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 243.13899 |
| Heavy Atoms | 16 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 18855-04-4 |
|---|---|
| SMILES | CC(C)C[NH2+]C(C)C(C1=CC=CC=C1)O.[Cl-] |
| InChIKey | SMHOFWWRACCYAD-UHFFFAOYSA-N |
Product Overview
Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride (CAS 18855-04-4), with molecular formula C13H22ClNO and molecular weight 243.14 g/mol. IUPAC: (1-hydroxy-1-phenylpropan-2-yl)-(2-methylpropyl)azanium chloride.
Chemical Property Profile of Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride
Property Insights of Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride
The XLogP value of -1.67 indicates that Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.8 Ų, Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride has 2 hydrogen bond donor(s) and 2 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 Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride?
The CAS number of Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride is 18855-04-4.
What is the molecular formula of Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride?
The molecular formula of Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride is C13H22ClNO.
What is the molecular weight of Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride?
The molecular weight of Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride is 243.14 g/mol.
Where can I buy Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride?
You can request a quote for Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.