庚基 N-苄基氨基甲酸酯
TL;DR: 庚基 N-苄基氨基甲酸酯 (CAS 124069-02-9) is a chemical compound with molecular formula C15H23NO2 and molecular weight 249.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
庚基 N-苄基氨基甲酸酯
heptyl N-benzylcarbamate
Also Known As: Heptyl N-benzylcarbamate, heptylN-benzylcarbamate, Heptyl hydrogen benzylcarbonimidate, Carbamic acid, (phenylmethyl)-, heptyl ester, Carbamic acid,(phenylmethyl)-, heptyl ester (9CI)
| Molecular Formula | C15H23NO2 |
|---|---|
| Molecular Weight | 249.17 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 249.17288 |
| Heavy Atoms | 18 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 124069-02-9 |
|---|---|
| SMILES | CCCCCCCOC(=O)NCC1=CC=CC=C1 |
| InChIKey | MXUHLRHMVNWCRP-UHFFFAOYSA-N |
Product Overview
庚基 N-苄基氨基甲酸酯 (CAS 124069-02-9), with molecular formula C15H23NO2 and molecular weight 249.17 g/mol. IUPAC: heptyl N-benzylcarbamate.
Chemical Property Profile of 庚基 N-苄基氨基甲酸酯
Property Insights of 庚基 N-苄基氨基甲酸酯
The XLogP value of 4.3 indicates that 庚基 N-苄基氨基甲酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, 庚基 N-苄基氨基甲酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 庚基 N-苄基氨基甲酸酯 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 庚基 N-苄基氨基甲酸酯?
The CAS number of 庚基 N-苄基氨基甲酸酯 is 124069-02-9.
What is the molecular formula of 庚基 N-苄基氨基甲酸酯?
The molecular formula of 庚基 N-苄基氨基甲酸酯 is C15H23NO2.
What is the molecular weight of 庚基 N-苄基氨基甲酸酯?
The molecular weight of 庚基 N-苄基氨基甲酸酯 is 249.17 g/mol.
Where can I buy 庚基 N-苄基氨基甲酸酯?
You can request a quote for 庚基 N-苄基氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 庚基 N-苄基氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 庚基 N-苄基氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.