![1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid structure](/static/products/891/891-58-7.png)
1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid
TL;DR: 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid (CAS 891-58-7) is a chemical compound with molecular formula C16H12O2 and molecular weight 236.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid
Also Known As: 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid, 2-(4-Methoxyphenyl)-5-chlor-benzoxazol, 1a,9b-dihydro-1H-cyclopropa[l]phenanthren-1-carbonsäure
| Molecular Formula | C16H12O2 |
|---|---|
| Molecular Weight | 236.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.08372 |
| Heavy Atoms | 18 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 891-58-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3C(C3C(=O)O)C4=CC=CC=C42 |
| InChIKey | QANUWSLNGNIGJC-UHFFFAOYSA-N |
Product Overview
1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid (CAS 891-58-7), with molecular formula C16H12O2 and molecular weight 236.08 g/mol. IUPAC: 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid.
Chemical Property Profile of 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid
Property Insights of 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid 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 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid?
The CAS number of 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid is 891-58-7.
What is the molecular formula of 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid?
The molecular formula of 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid is C16H12O2.
What is the molecular weight of 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid?
The molecular weight of 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid is 236.08 g/mol.
Where can I buy 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid?
You can request a quote for 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1a,9b-dihydro-1H-cyclopropa[l]phenanthrene-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.