2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1)
TL;DR: 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1) (CAS 63991-38-8) is a chemical compound with molecular formula C12H20ClNO and molecular weight 229.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl-(2-hydroxy-2-phenylethyl)azanium chloride
Also Known As: BENZYL ALCOHOL, alpha-BUTYLAMINOMETHYL, HYDROCHLORIDE, (+-)-, butyl-(2-hydroxy-2-phenylethyl)azanium chloride, 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1), Benzenemethanol, .alpha.-[(butylamino)methyl]-, hydrochloride, (.+.)-, RefChem:1061501
| Molecular Formula | C12H20ClNO |
|---|---|
| Molecular Weight | 229.12 g/mol |
| LogP | -1.91 |
| Topological Polar Surface Area | 36.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 229.12334 |
| Heavy Atoms | 15 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 63991-38-8 |
|---|---|
| SMILES | CCCC[NH2+]CC(C1=CC=CC=C1)O.[Cl-] |
| InChIKey | IBQXSHMLSZXUHF-UHFFFAOYSA-N |
Product Overview
2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1) (CAS 63991-38-8), with molecular formula C12H20ClNO and molecular weight 229.12 g/mol. IUPAC: butyl-(2-hydroxy-2-phenylethyl)azanium chloride.
Chemical Property Profile of 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1)
Property Insights of 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1)
The XLogP value of -1.91 indicates that 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1) 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, 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1) 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 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1)?
The CAS number of 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1) is 63991-38-8.
What is the molecular formula of 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1)?
The molecular formula of 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1) is C12H20ClNO.
What is the molecular weight of 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1)?
The molecular weight of 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1) is 229.12 g/mol.
Where can I buy 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1)?
You can request a quote for 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2-(Butylamino)-1-phenylethan-1-ol--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.