Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate
TL;DR: Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate (CAS 69353-14-6) is a chemical compound with molecular formula C12H18N2O2 and molecular weight 222.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(1-phenylpropylamino)carbamate
Also Known As: Ethyl 3-(alpha-ethylbenzyl)carbazate, ethyl N-(1-phenylpropylamino)carbamate, Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate, 1-(alpha-Ethylbenzyl)-2-ethoxycarbonylhydrazin, 3-(alpha-Ethylbenzyl)carbazic acid ethyl ester
| Molecular Formula | C12H18N2O2 |
|---|---|
| Molecular Weight | 222.14 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 222.13683 |
| Heavy Atoms | 16 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 69353-14-6 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1)NNC(=O)OCC |
| InChIKey | IBGZAFPWAXOXGF-UHFFFAOYSA-N |
Product Overview
Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate (CAS 69353-14-6), with molecular formula C12H18N2O2 and molecular weight 222.14 g/mol. IUPAC: ethyl N-(1-phenylpropylamino)carbamate.
Chemical Property Profile of Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate
Property Insights of Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate. With a topological polar surface area (TPSA) of 50.4 Ų, Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate has 2 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 Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate?
The CAS number of Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate is 69353-14-6.
What is the molecular formula of Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate?
The molecular formula of Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate is C12H18N2O2.
What is the molecular weight of Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate?
The molecular weight of Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate is 222.14 g/mol.
Where can I buy Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate?
You can request a quote for Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.