Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester
TL;DR: Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester (CAS 717-17-9) is a chemical compound with molecular formula C10H13FN2O2 and molecular weight 212.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[1-(4-fluorophenyl)ethylamino]carbamate
Also Known As: Methyl (p-fluoro-alpha-methylbenzyl)carbazate, methyl N-[1-(4-fluorophenyl)ethylamino]carbamate, CARBAZIC ACID, 3-(p-FLUORO-alpha-METHYLBENZYL)-, METHYL ESTER, 1-(4-Fluor-alpha-methyl-benzyl)-2-methoxycarbonyl-hydrazin, 3-(p-Fluoro-alpha-methylbenzyl)carbazic acid methyl ester
| Molecular Formula | C10H13FN2O2 |
|---|---|
| Molecular Weight | 212.10 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 212.0961 |
| Heavy Atoms | 15 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 717-17-9 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)F)NNC(=O)OC |
| InChIKey | VVWMCYCIYUMQBV-UHFFFAOYSA-N |
Product Overview
Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester (CAS 717-17-9), with molecular formula C10H13FN2O2 and molecular weight 212.10 g/mol. IUPAC: methyl N-[1-(4-fluorophenyl)ethylamino]carbamate.
Chemical Property Profile of Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester
Property Insights of Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester. With a topological polar surface area (TPSA) of 50.4 Ų, Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester 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 Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester?
The CAS number of Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester is 717-17-9.
What is the molecular formula of Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester?
The molecular formula of Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester is C10H13FN2O2.
What is the molecular weight of Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester?
The molecular weight of Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester is 212.10 g/mol.
Where can I buy Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester?
You can request a quote for Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbazic acid, 3-(p-fluoro-alpha-methylbenzyl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.