![tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate structure](/static/products/5852/58521-45-2.webp)
tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate
TL;DR: tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate (CAS 58521-45-2) is a chemical compound with molecular formula C11H21NO3 and molecular weight 215.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate
Also Known As: Boc-Leucinal, Boc-Leu-H, (S)-Boc-Leucinal, Boc--L--Leucinal, BOC-L-LEUCINAL
| Molecular Formula | C11H21NO3 |
|---|---|
| Molecular Weight | 215.15 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 215.15215 |
| Heavy Atoms | 15 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 58521-45-2 |
|---|---|
| SMILES | CC(C)C[C@@H](C=O)NC(=O)OC(C)(C)C |
| InChIKey | RQSBRFZHUKLKNO-VIFPVBQESA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate (CAS 58521-45-2), with molecular formula C11H21NO3 and molecular weight 215.15 g/mol. IUPAC: tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate.
Chemical Property Profile of tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate
Property Insights of tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate. With a topological polar surface area (TPSA) of 55.4 Ų, tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate has 1 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 N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate?
The CAS number of tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate is 58521-45-2.
What is the molecular formula of tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate?
The molecular formula of tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate is C11H21NO3.
What is the molecular weight of tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate?
The molecular weight of tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate is 215.15 g/mol.
Where can I buy tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate?
You can request a quote for tert-butyl N-[(2S)-4-methyl-1-oxopentan-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 N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-[(2S)-4-methyl-1-oxopentan-2-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.