tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate
TL;DR: tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate (CAS 69353-16-8) is a chemical compound with molecular formula C13H20N2O2 and molecular weight 236.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(1-phenylethylamino)carbamate
Also Known As: tert-Butyl (3-alpha-methylbenzyl)carbazate, tert-butyl N-(1-phenylethylamino)carbamate, N'-(1-phenylethyl)(tert-butoxy)carbohydrazide, tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate, tert-butyl 2-(1-phenylethyl)hydrazinecarboxylate
| Molecular Formula | C13H20N2O2 |
|---|---|
| Molecular Weight | 236.15 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 236.15248 |
| Heavy Atoms | 17 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 69353-16-8 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)NNC(=O)OC(C)(C)C |
| InChIKey | OLRFEBCHQKZIAX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate (CAS 69353-16-8), with molecular formula C13H20N2O2 and molecular weight 236.15 g/mol. IUPAC: tert-butyl N-(1-phenylethylamino)carbamate.
Chemical Property Profile of tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate
Property Insights of tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate. With a topological polar surface area (TPSA) of 50.4 Ų, tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-Butyl hydrogen (1-phenylethyl)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 tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate?
The CAS number of tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate is 69353-16-8.
What is the molecular formula of tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate?
The molecular formula of tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate is C13H20N2O2.
What is the molecular weight of tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate?
The molecular weight of tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate is 236.15 g/mol.
Where can I buy tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate?
You can request a quote for tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl hydrogen (1-phenylethyl)carbonohydrazonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.