tert-Butyl (4-hydroxybutan-2-yl)carbamate
TL;DR: tert-Butyl (4-hydroxybutan-2-yl)carbamate (CAS 106539-36-0) 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-(4-hydroxybutan-2-yl)carbamate
Also Known As: tert-Butyl (4-hydroxybutan-2-yl)carbamate, 3-(Boc-amino)-1-butanol, N-Boc-3-Amino-1-butanol, tert-butyl N-(4-hydroxybutan-2-yl)carbamate, DL-3-(BOC-Amino)-1-butanol
| Molecular Formula | C9H19NO3 |
|---|---|
| Molecular Weight | 189.14 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 189.13649 |
| Heavy Atoms | 13 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 106539-36-0 |
|---|---|
| SMILES | CC(CCO)NC(=O)OC(C)(C)C |
| InChIKey | JSZOAOLSEKSNTD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
tert-Butyl (4-hydroxybutan-2-yl)carbamate (CAS 106539-36-0), with molecular formula C9H19NO3 and molecular weight 189.14 g/mol. IUPAC: tert-butyl N-(4-hydroxybutan-2-yl)carbamate.
Chemical Property Profile of tert-Butyl (4-hydroxybutan-2-yl)carbamate
Property Insights of tert-Butyl (4-hydroxybutan-2-yl)carbamate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyl (4-hydroxybutan-2-yl)carbamate. With a topological polar surface area (TPSA) of 58.6 Ų, tert-Butyl (4-hydroxybutan-2-yl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-Butyl (4-hydroxybutan-2-yl)carbamate 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 tert-Butyl (4-hydroxybutan-2-yl)carbamate?
The CAS number of tert-Butyl (4-hydroxybutan-2-yl)carbamate is 106539-36-0.
What is the molecular formula of tert-Butyl (4-hydroxybutan-2-yl)carbamate?
The molecular formula of tert-Butyl (4-hydroxybutan-2-yl)carbamate is C9H19NO3.
What is the molecular weight of tert-Butyl (4-hydroxybutan-2-yl)carbamate?
The molecular weight of tert-Butyl (4-hydroxybutan-2-yl)carbamate is 189.14 g/mol.
Where can I buy tert-Butyl (4-hydroxybutan-2-yl)carbamate?
You can request a quote for tert-Butyl (4-hydroxybutan-2-yl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butyl (4-hydroxybutan-2-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl (4-hydroxybutan-2-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.