(3-phenoxyphenyl) N-tert-butylcarbamate
TL;DR: (3-phenoxyphenyl) N-tert-butylcarbamate (CAS 98992-40-6) is a chemical compound with molecular formula C17H19NO3 and molecular weight 285.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-phenoxyphenyl) N-tert-butylcarbamate
Also Known As: (3-phenoxyphenyl) N-tert-butylcarbamate, 3-phenoxyphenyl tert-butylcarbamate, Carbamic acid, (1,1-dimethylethyl)-, 3-phenoxyphenyl ester
| Molecular Formula | C17H19NO3 |
|---|---|
| Molecular Weight | 285.14 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 285.1365 |
| Heavy Atoms | 21 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 98992-40-6 |
|---|---|
| SMILES | CC(C)(C)NC(=O)OC1=CC=CC(=C1)OC2=CC=CC=C2 |
| InChIKey | OKQWCHQZBZCNGR-UHFFFAOYSA-N |
Product Overview
(3-phenoxyphenyl) N-tert-butylcarbamate (CAS 98992-40-6), with molecular formula C17H19NO3 and molecular weight 285.14 g/mol. IUPAC: (3-phenoxyphenyl) N-tert-butylcarbamate.
Chemical Property Profile of (3-phenoxyphenyl) N-tert-butylcarbamate
Property Insights of (3-phenoxyphenyl) N-tert-butylcarbamate
The XLogP value of 4.0 indicates that (3-phenoxyphenyl) N-tert-butylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, (3-phenoxyphenyl) N-tert-butylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-phenoxyphenyl) N-tert-butylcarbamate 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 (3-phenoxyphenyl) N-tert-butylcarbamate?
The CAS number of (3-phenoxyphenyl) N-tert-butylcarbamate is 98992-40-6.
What is the molecular formula of (3-phenoxyphenyl) N-tert-butylcarbamate?
The molecular formula of (3-phenoxyphenyl) N-tert-butylcarbamate is C17H19NO3.
What is the molecular weight of (3-phenoxyphenyl) N-tert-butylcarbamate?
The molecular weight of (3-phenoxyphenyl) N-tert-butylcarbamate is 285.14 g/mol.
Where can I buy (3-phenoxyphenyl) N-tert-butylcarbamate?
You can request a quote for (3-phenoxyphenyl) N-tert-butylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-phenoxyphenyl) N-tert-butylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for (3-phenoxyphenyl) N-tert-butylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.