Benzeneethanol, alpha-butyl-
TL;DR: Benzeneethanol, alpha-butyl- (CAS 25755-72-0) is a chemical compound with molecular formula C12H18O and molecular weight 178.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylhexan-2-ol
Also Known As: 1-phenylhexan-2-ol, 1-PHENYL-2-HEXANOL, Benzeneethanol, alpha-butyl-, Benzeneethanol, ?-butyl-, Benzeneethanol, .alpha.-butyl-
| Molecular Formula | C12H18O |
|---|---|
| Molecular Weight | 178.14 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 178.13577 |
| Heavy Atoms | 13 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 25755-72-0 |
|---|---|
| SMILES | CCCCC(CC1=CC=CC=C1)O |
| InChIKey | JIYIWMCPWCFVCA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzeneethanol, alpha-butyl- (CAS 25755-72-0), with molecular formula C12H18O and molecular weight 178.14 g/mol. IUPAC: 1-phenylhexan-2-ol.
Chemical Property Profile of Benzeneethanol, alpha-butyl-
Property Insights of Benzeneethanol, alpha-butyl-
The XLogP value of 3.6 indicates that Benzeneethanol, alpha-butyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Benzeneethanol, alpha-butyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneethanol, alpha-butyl- 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 Benzeneethanol, alpha-butyl-?
The CAS number of Benzeneethanol, alpha-butyl- is 25755-72-0.
What is the molecular formula of Benzeneethanol, alpha-butyl-?
The molecular formula of Benzeneethanol, alpha-butyl- is C12H18O.
What is the molecular weight of Benzeneethanol, alpha-butyl-?
The molecular weight of Benzeneethanol, alpha-butyl- is 178.14 g/mol.
Where can I buy Benzeneethanol, alpha-butyl-?
You can request a quote for Benzeneethanol, alpha-butyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneethanol, alpha-butyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneethanol, alpha-butyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.