Carbamic acid, (p-iodobenzyl)-, hexyl ester
TL;DR: Carbamic acid, (p-iodobenzyl)-, hexyl ester (CAS 67987-35-3) is a chemical compound with molecular formula C14H20INO2 and molecular weight 361.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexyl N-[(4-iodophenyl)methyl]carbamate
Also Known As: (p-Iodobenzyl)carbamic acid hexyl ester, CARBAMIC ACID, (p-IODOBENZYL)-, HEXYL ESTER, hexyl N-[(4-iodophenyl)methyl]carbamate, Hexyl [(4-iodophenyl)methyl]carbamate, N-(p-Iodobenzyl)carbamic acid hexyl ester
| Molecular Formula | C14H20INO2 |
|---|---|
| Molecular Weight | 361.05 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 361.0539 |
| Heavy Atoms | 18 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 67987-35-3 |
|---|---|
| SMILES | CCCCCCOC(=O)NCC1=CC=C(C=C1)I |
| InChIKey | AOUBHJPKNQRCOI-UHFFFAOYSA-N |
Product Overview
Carbamic acid, (p-iodobenzyl)-, hexyl ester (CAS 67987-35-3), with molecular formula C14H20INO2 and molecular weight 361.05 g/mol. IUPAC: hexyl N-[(4-iodophenyl)methyl]carbamate.
Chemical Property Profile of Carbamic acid, (p-iodobenzyl)-, hexyl ester
Property Insights of Carbamic acid, (p-iodobenzyl)-, hexyl ester
The XLogP value of 4.4 indicates that Carbamic acid, (p-iodobenzyl)-, hexyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Carbamic acid, (p-iodobenzyl)-, hexyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, (p-iodobenzyl)-, hexyl ester has 1 hydrogen bond donor(s) and 2 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 Carbamic acid, (p-iodobenzyl)-, hexyl ester?
The CAS number of Carbamic acid, (p-iodobenzyl)-, hexyl ester is 67987-35-3.
What is the molecular formula of Carbamic acid, (p-iodobenzyl)-, hexyl ester?
The molecular formula of Carbamic acid, (p-iodobenzyl)-, hexyl ester is C14H20INO2.
What is the molecular weight of Carbamic acid, (p-iodobenzyl)-, hexyl ester?
The molecular weight of Carbamic acid, (p-iodobenzyl)-, hexyl ester is 361.05 g/mol.
Where can I buy Carbamic acid, (p-iodobenzyl)-, hexyl ester?
You can request a quote for Carbamic acid, (p-iodobenzyl)-, hexyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, (p-iodobenzyl)-, hexyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (p-iodobenzyl)-, hexyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.