(S)-(-)-2-(Boc-amino)-1,4-butanediol
TL;DR: (S)-(-)-2-(Boc-amino)-1,4-butanediol (CAS 397246-14-9) is a chemical compound with molecular formula C9H19NO4 and molecular weight 205.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(2S)-1,4-dihydroxybutan-2-yl]carbamate
Also Known As: (S)-(-)-2-(Boc-amino)-1,4-butanediol, (S)-N-Boc-2-Aminobutane-1,4-diol, -1,4-Butanediol, (S)-N-BOC-2-AMINO-BUTANE-1,4-DIOL, 5-bromopentyl(phenyl)sulfone
| Molecular Formula | C9H19NO4 |
|---|---|
| Molecular Weight | 205.13 g/mol |
| LogP | 0.2544 |
| Topological Polar Surface Area | 78.79 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 205.13141 |
| Heavy Atoms | 14 |
| Complexity | 176.14099 |
Chemical Identifiers
| CAS Number | 397246-14-9 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CCO)CO |
Product Overview
(S)-(-)-2-(Boc-amino)-1,4-butanediol (CAS 397246-14-9), with molecular formula C9H19NO4 and molecular weight 205.13 g/mol. IUPAC: tert-butyl N-[(2S)-1,4-dihydroxybutan-2-yl]carbamate.
Chemical Property Profile of (S)-(-)-2-(Boc-amino)-1,4-butanediol
Property Insights of (S)-(-)-2-(Boc-amino)-1,4-butanediol
The XLogP value of 0.2544 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-(-)-2-(Boc-amino)-1,4-butanediol. The TPSA of 78.79 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-(-)-2-(Boc-amino)-1,4-butanediol. Following Lipinski's Rule of Five, (S)-(-)-2-(Boc-amino)-1,4-butanediol has 3 hydrogen bond donor(s) and 4 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 (S)-(-)-2-(Boc-amino)-1,4-butanediol?
The CAS number of (S)-(-)-2-(Boc-amino)-1,4-butanediol is 397246-14-9.
What is the molecular formula of (S)-(-)-2-(Boc-amino)-1,4-butanediol?
The molecular formula of (S)-(-)-2-(Boc-amino)-1,4-butanediol is C9H19NO4.
What is the molecular weight of (S)-(-)-2-(Boc-amino)-1,4-butanediol?
The molecular weight of (S)-(-)-2-(Boc-amino)-1,4-butanediol is 205.13 g/mol.
Where can I buy (S)-(-)-2-(Boc-amino)-1,4-butanediol?
You can request a quote for (S)-(-)-2-(Boc-amino)-1,4-butanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-(-)-2-(Boc-amino)-1,4-butanediol?
Yes, KEHONG BIO provides custom synthesis services for (S)-(-)-2-(Boc-amino)-1,4-butanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.