1,1-Dimethylethyl N-(4-formylphenyl)carbamate
TL;DR: 1,1-Dimethylethyl N-(4-formylphenyl)carbamate (CAS 144072-30-0) is a chemical compound with molecular formula C12H15NO3 and molecular weight 221.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(4-formylphenyl)carbamate
Also Known As: tert-Butyl 4-formylphenylcarbamate, 4-(BOC-AMINO)BENZALDEHYDE, Tert-butyl N-(4-formylphenyl)carbamate, TERT-BUTYL (4-FORMYLPHENYL)CARBAMATE, Boc-DL-Phe-ol
| Molecular Formula | C12H15NO3 |
|---|---|
| Molecular Weight | 221.11 g/mol |
| LogP | 2.8461 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.1052 |
| Heavy Atoms | 16 |
| Complexity | 376.2455 |
Chemical Identifiers
| CAS Number | 144072-30-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC1=CC=C(C=C1)C=O |
Product Overview
1,1-Dimethylethyl N-(4-formylphenyl)carbamate (CAS 144072-30-0), with molecular formula C12H15NO3 and molecular weight 221.11 g/mol. IUPAC: tert-butyl N-(4-formylphenyl)carbamate.
Chemical Property Profile of 1,1-Dimethylethyl N-(4-formylphenyl)carbamate
Property Insights of 1,1-Dimethylethyl N-(4-formylphenyl)carbamate
The XLogP value of 2.8461 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Dimethylethyl N-(4-formylphenyl)carbamate. With a topological polar surface area (TPSA) of 55.4 Ų, 1,1-Dimethylethyl N-(4-formylphenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Dimethylethyl N-(4-formylphenyl)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 1,1-Dimethylethyl N-(4-formylphenyl)carbamate?
The CAS number of 1,1-Dimethylethyl N-(4-formylphenyl)carbamate is 144072-30-0.
What is the molecular formula of 1,1-Dimethylethyl N-(4-formylphenyl)carbamate?
The molecular formula of 1,1-Dimethylethyl N-(4-formylphenyl)carbamate is C12H15NO3.
What is the molecular weight of 1,1-Dimethylethyl N-(4-formylphenyl)carbamate?
The molecular weight of 1,1-Dimethylethyl N-(4-formylphenyl)carbamate is 221.11 g/mol.
Where can I buy 1,1-Dimethylethyl N-(4-formylphenyl)carbamate?
You can request a quote for 1,1-Dimethylethyl N-(4-formylphenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Dimethylethyl N-(4-formylphenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Dimethylethyl N-(4-formylphenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.