tert-Butyl (3-formylpyridin-4-yl)carbamate
TL;DR: tert-Butyl (3-formylpyridin-4-yl)carbamate (CAS 773132-83-5) is a chemical compound with molecular formula C11H14N2O3 and molecular weight 222.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(3-formyl-4-pyridinyl)carbamate
Also Known As: tert-Butyl (3-formylpyridin-4-yl)carbamate, tert-Butyl 3-formylpyridin-4-ylcarbamate, Tert-butyl N-(3-formylpyridin-4-yl)carbamate, 1-Adamantaneacetic acid, 4-(Boc-amino)nicotinaldehyde
| Molecular Formula | C11H14N2O3 |
|---|---|
| Molecular Weight | 222.10 g/mol |
| LogP | 2.2411 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.10045 |
| Heavy Atoms | 16 |
| Complexity | 396.4613 |
Chemical Identifiers
| CAS Number | 773132-83-5 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC1=C(C=NC=C1)C=O |
Product Overview
tert-Butyl (3-formylpyridin-4-yl)carbamate (CAS 773132-83-5), with molecular formula C11H14N2O3 and molecular weight 222.10 g/mol. IUPAC: tert-butyl N-(3-formyl-4-pyridinyl)carbamate.
Chemical Property Profile of tert-Butyl (3-formylpyridin-4-yl)carbamate
Property Insights of tert-Butyl (3-formylpyridin-4-yl)carbamate
The XLogP value of 2.2411 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyl (3-formylpyridin-4-yl)carbamate. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-Butyl (3-formylpyridin-4-yl)carbamate. Following Lipinski's Rule of Five, tert-Butyl (3-formylpyridin-4-yl)carbamate has 1 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 tert-Butyl (3-formylpyridin-4-yl)carbamate?
The CAS number of tert-Butyl (3-formylpyridin-4-yl)carbamate is 773132-83-5.
What is the molecular formula of tert-Butyl (3-formylpyridin-4-yl)carbamate?
The molecular formula of tert-Butyl (3-formylpyridin-4-yl)carbamate is C11H14N2O3.
What is the molecular weight of tert-Butyl (3-formylpyridin-4-yl)carbamate?
The molecular weight of tert-Butyl (3-formylpyridin-4-yl)carbamate is 222.10 g/mol.
Where can I buy tert-Butyl (3-formylpyridin-4-yl)carbamate?
You can request a quote for tert-Butyl (3-formylpyridin-4-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 (3-formylpyridin-4-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl (3-formylpyridin-4-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.