Benz(a)anthracene-7-ethanol, 12-methyl-
TL;DR: Benz(a)anthracene-7-ethanol, 12-methyl- (CAS 13345-58-9) is a chemical compound with molecular formula C21H18O and molecular weight 286.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(12-methylbenzo[a]anthracen-7-yl)ethanol
Also Known As: Benz(a)anthracene-7-ethanol, 12-methyl-, 7-(2-Hydroxyethyl)-12-methylbenz(a)anthracene, 2-(12-methylbenzo[a]anthracen-7-yl)ethanol, 2-(12-methyltetraphen-7-yl)ethan-1-ol, 2-(12-methyltetraphen-7-yl)ethanol
| Molecular Formula | C21H18O |
|---|---|
| Molecular Weight | 286.14 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.13577 |
| Heavy Atoms | 22 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 13345-58-9 |
|---|---|
| SMILES | CC1=C2C(=C(C3=CC=CC=C13)CCO)C=CC4=CC=CC=C42 |
| InChIKey | IXGOHTMJBQGTMH-UHFFFAOYSA-N |
Product Overview
Benz(a)anthracene-7-ethanol, 12-methyl- (CAS 13345-58-9), with molecular formula C21H18O and molecular weight 286.14 g/mol. IUPAC: 2-(12-methylbenzo[a]anthracen-7-yl)ethanol.
Chemical Property Profile of Benz(a)anthracene-7-ethanol, 12-methyl-
Property Insights of Benz(a)anthracene-7-ethanol, 12-methyl-
The XLogP value of 5.0 indicates that Benz(a)anthracene-7-ethanol, 12-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Benz(a)anthracene-7-ethanol, 12-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benz(a)anthracene-7-ethanol, 12-methyl- 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 Benz(a)anthracene-7-ethanol, 12-methyl-?
The CAS number of Benz(a)anthracene-7-ethanol, 12-methyl- is 13345-58-9.
What is the molecular formula of Benz(a)anthracene-7-ethanol, 12-methyl-?
The molecular formula of Benz(a)anthracene-7-ethanol, 12-methyl- is C21H18O.
What is the molecular weight of Benz(a)anthracene-7-ethanol, 12-methyl-?
The molecular weight of Benz(a)anthracene-7-ethanol, 12-methyl- is 286.14 g/mol.
Where can I buy Benz(a)anthracene-7-ethanol, 12-methyl-?
You can request a quote for Benz(a)anthracene-7-ethanol, 12-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benz(a)anthracene-7-ethanol, 12-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Benz(a)anthracene-7-ethanol, 12-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.