1-Phenylheptan-1-ol
TL;DR: 1-Phenylheptan-1-ol (CAS 1334-90-3) is a chemical compound with molecular formula C13H20O and molecular weight 192.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylheptan-1-ol
Also Known As: 1-phenyl-1-heptanol, 1-phenylheptan-1-ol, phenyl heptanol, Hexylphenylcarbinol, p-Hydroxyheptylbenzene
| Molecular Formula | C13H20O |
|---|---|
| Molecular Weight | 192.15 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 192.15141 |
| Heavy Atoms | 14 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 1334-90-3 |
|---|---|
| SMILES | CCCCCCC(C1=CC=CC=C1)O |
| InChIKey | UAJVCELPUNHGKE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenylheptan-1-ol (CAS 1334-90-3), with molecular formula C13H20O and molecular weight 192.15 g/mol. IUPAC: 1-phenylheptan-1-ol.
Chemical Property Profile of 1-Phenylheptan-1-ol
Property Insights of 1-Phenylheptan-1-ol
The XLogP value of 3.9 indicates that 1-Phenylheptan-1-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 1-Phenylheptan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenylheptan-1-ol has 1 hydrogen bond donor(s) and 1 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 1-Phenylheptan-1-ol?
The CAS number of 1-Phenylheptan-1-ol is 1334-90-3.
What is the molecular formula of 1-Phenylheptan-1-ol?
The molecular formula of 1-Phenylheptan-1-ol is C13H20O.
What is the molecular weight of 1-Phenylheptan-1-ol?
The molecular weight of 1-Phenylheptan-1-ol is 192.15 g/mol.
Where can I buy 1-Phenylheptan-1-ol?
You can request a quote for 1-Phenylheptan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenylheptan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenylheptan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.