2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate
TL;DR: 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate (CAS 7467-81-4) is a chemical compound with molecular formula C16H25NO2 and molecular weight 263.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate
Also Known As: 5-di-t-butylphenyl methyl carbamate, 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate, 2,2,4,4-Tetramethylpentan-3-yl phenylcarbamate, 3-PENTANOL,2,2,4,4-TETRAMETHYL-, 3-(N-PHENYLCARBAMATE), RefChem:242846
| Molecular Formula | C16H25NO2 |
|---|---|
| Molecular Weight | 263.19 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 263.18854 |
| Heavy Atoms | 19 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 7467-81-4 |
|---|---|
| SMILES | CC(C)(C)C(C(C)(C)C)OC(=O)NC1=CC=CC=C1 |
| InChIKey | ZXJFUPSUJNJUOV-UHFFFAOYSA-N |
Product Overview
2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate (CAS 7467-81-4), with molecular formula C16H25NO2 and molecular weight 263.19 g/mol. IUPAC: 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate.
Chemical Property Profile of 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate
Property Insights of 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate
The XLogP value of 5.3 indicates that 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate?
The CAS number of 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate is 7467-81-4.
What is the molecular formula of 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate?
The molecular formula of 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate is C16H25NO2.
What is the molecular weight of 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate?
The molecular weight of 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate is 263.19 g/mol.
Where can I buy 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate?
You can request a quote for 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 2,2,4,4-tetramethylpentan-3-yl N-phenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.