3-(Boc-amino)-2-butanol
TL;DR: 3-(Boc-amino)-2-butanol (CAS 752135-63-0) is a chemical compound with molecular formula C9H19NO3 and molecular weight 189.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(3-hydroxybutan-2-yl)carbamate
Also Known As: 3-(Boc-amino)-2-butanol, tert-butyl (3-hydroxybutan-2-yl)carbamate, tert-butyl N-(3-hydroxybutan-2-yl)carbamate, 2-(CHLOROMETHYL)QUINAZOLINE, 5686AJ
| Molecular Formula | C9H19NO3 |
|---|---|
| Molecular Weight | 189.14 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 189.13649 |
| Heavy Atoms | 13 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 752135-63-0 |
|---|---|
| SMILES | CC(C(C)O)NC(=O)OC(C)(C)C |
| InChIKey | CHYWVAGOJXWXIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Boc-amino)-2-butanol (CAS 752135-63-0), with molecular formula C9H19NO3 and molecular weight 189.14 g/mol. IUPAC: tert-butyl N-(3-hydroxybutan-2-yl)carbamate.
Chemical Property Profile of 3-(Boc-amino)-2-butanol
Property Insights of 3-(Boc-amino)-2-butanol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Boc-amino)-2-butanol. With a topological polar surface area (TPSA) of 58.6 Ų, 3-(Boc-amino)-2-butanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Boc-amino)-2-butanol has 2 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 3-(Boc-amino)-2-butanol?
The CAS number of 3-(Boc-amino)-2-butanol is 752135-63-0.
What is the molecular formula of 3-(Boc-amino)-2-butanol?
The molecular formula of 3-(Boc-amino)-2-butanol is C9H19NO3.
What is the molecular weight of 3-(Boc-amino)-2-butanol?
The molecular weight of 3-(Boc-amino)-2-butanol is 189.14 g/mol.
Where can I buy 3-(Boc-amino)-2-butanol?
You can request a quote for 3-(Boc-amino)-2-butanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Boc-amino)-2-butanol?
Yes, KEHONG BIO provides custom synthesis services for 3-(Boc-amino)-2-butanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.