![[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate structure](/static/products/1996/19961-80-9.webp)
[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate
TL;DR: [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate (CAS 19961-80-9) is a chemical compound with molecular formula C13H18N2O4 and molecular weight 266.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate
Also Known As: 3-[(tert-Butoxycarbonyl)amino]phenyl methylcarbamate, [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate, [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylca
| Molecular Formula | C13H18N2O4 |
|---|---|
| Molecular Weight | 266.13 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 266.12665 |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 19961-80-9 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC1=CC(=CC=C1)OC(=O)NC |
| InChIKey | SOHPSFVASBQPBN-UHFFFAOYSA-N |
Product Overview
[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate (CAS 19961-80-9), with molecular formula C13H18N2O4 and molecular weight 266.13 g/mol. IUPAC: [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate.
Chemical Property Profile of [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate
Property Insights of [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate. Following Lipinski's Rule of Five, [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate has 2 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 [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate?
The CAS number of [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate is 19961-80-9.
What is the molecular formula of [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate?
The molecular formula of [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate is C13H18N2O4.
What is the molecular weight of [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate?
The molecular weight of [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate is 266.13 g/mol.
Where can I buy [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate?
You can request a quote for [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.