prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate
TL;DR: prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate (CAS 73622-96-5) is a chemical compound with molecular formula C10H10N2O4 and molecular weight 222.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate
Also Known As: Dipropargyl vinylenedicarbamate, N,N'-Vinylenedicarbamicaciddi ester
| Molecular Formula | C10H10N2O4 |
|---|---|
| Molecular Weight | 222.06 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 222.06406 |
| Heavy Atoms | 16 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 73622-96-5 |
|---|---|
| SMILES | C#CCOC(=O)NC=CNC(=O)OCC#C |
| InChIKey | XXZKBIWYSMINMA-UHFFFAOYSA-N |
Product Overview
prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate (CAS 73622-96-5), with molecular formula C10H10N2O4 and molecular weight 222.06 g/mol. IUPAC: prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate.
Chemical Property Profile of prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate
Property Insights of prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate
The XLogP value of -0.1 indicates that prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate. Following Lipinski's Rule of Five, prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]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 prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate?
The CAS number of prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate is 73622-96-5.
What is the molecular formula of prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate?
The molecular formula of prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate is C10H10N2O4.
What is the molecular weight of prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate?
The molecular weight of prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate is 222.06 g/mol.
Where can I buy prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate?
You can request a quote for prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for prop-2-ynyl N-[2-(prop-2-ynoxycarbonylamino)ethenyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.