![butyl N-[(butoxycarbonylamino)methyl]carbamate structure](/static/products/2533/2533-21-3.webp)
butyl N-[(butoxycarbonylamino)methyl]carbamate
TL;DR: butyl N-[(butoxycarbonylamino)methyl]carbamate (CAS 2533-21-3) is a chemical compound with molecular formula C11H22N2O4 and molecular weight 246.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl N-[(butoxycarbonylamino)methyl]carbamate
Also Known As: Dibutyl methylenebiscarbamate, butyl N-[(butoxycarbonylamino)methyl]carbamate, Methylenebis(carbamic acid butyl) ester, J1.819.696D, Carbamicacid,methylenebis-,dibutyl ester (9CI)
| Molecular Formula | C11H22N2O4 |
|---|---|
| Molecular Weight | 246.16 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 246.15796 |
| Heavy Atoms | 17 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 2533-21-3 |
|---|---|
| SMILES | CCCCOC(=O)NCNC(=O)OCCCC |
| InChIKey | XIRMSNNTZFJODV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
butyl N-[(butoxycarbonylamino)methyl]carbamate (CAS 2533-21-3), with molecular formula C11H22N2O4 and molecular weight 246.16 g/mol. IUPAC: butyl N-[(butoxycarbonylamino)methyl]carbamate.
Chemical Property Profile of butyl N-[(butoxycarbonylamino)methyl]carbamate
Property Insights of butyl N-[(butoxycarbonylamino)methyl]carbamate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for butyl N-[(butoxycarbonylamino)methyl]carbamate. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for butyl N-[(butoxycarbonylamino)methyl]carbamate. Following Lipinski's Rule of Five, butyl N-[(butoxycarbonylamino)methyl]carbamate 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 butyl N-[(butoxycarbonylamino)methyl]carbamate?
The CAS number of butyl N-[(butoxycarbonylamino)methyl]carbamate is 2533-21-3.
What is the molecular formula of butyl N-[(butoxycarbonylamino)methyl]carbamate?
The molecular formula of butyl N-[(butoxycarbonylamino)methyl]carbamate is C11H22N2O4.
What is the molecular weight of butyl N-[(butoxycarbonylamino)methyl]carbamate?
The molecular weight of butyl N-[(butoxycarbonylamino)methyl]carbamate is 246.16 g/mol.
Where can I buy butyl N-[(butoxycarbonylamino)methyl]carbamate?
You can request a quote for butyl N-[(butoxycarbonylamino)methyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for butyl N-[(butoxycarbonylamino)methyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for butyl N-[(butoxycarbonylamino)methyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.