(2Z)-2-benzylidenebutanoic acid
TL;DR: (2Z)-2-benzylidenebutanoic acid (CAS 88153-39-3) is a chemical compound with molecular formula C11H12O2 and molecular weight 176.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-benzylidenebutanoic acid
Also Known As: (2Z)-2-benzylidenebutanoic acid, 2-benzylidenebutanoic acid, RefChem:854900
| Molecular Formula | C11H12O2 |
|---|---|
| Molecular Weight | 176.08 g/mol |
| LogP | 2.5646 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 176.08372 |
| Heavy Atoms | 13 |
| Complexity | 312.12198 |
Chemical Identifiers
| CAS Number | 88153-39-3 |
|---|---|
| SMILES | CC/C(=C/C1=CC=CC=C1)/C(=O)O |
Product Overview
(2Z)-2-benzylidenebutanoic acid (CAS 88153-39-3), with molecular formula C11H12O2 and molecular weight 176.08 g/mol. IUPAC: (2Z)-2-benzylidenebutanoic acid.
Chemical Property Profile of (2Z)-2-benzylidenebutanoic acid
Property Insights of (2Z)-2-benzylidenebutanoic acid
The XLogP value of 2.5646 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2Z)-2-benzylidenebutanoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, (2Z)-2-benzylidenebutanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2Z)-2-benzylidenebutanoic acid 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 (2Z)-2-benzylidenebutanoic acid?
The CAS number of (2Z)-2-benzylidenebutanoic acid is 88153-39-3.
What is the molecular formula of (2Z)-2-benzylidenebutanoic acid?
The molecular formula of (2Z)-2-benzylidenebutanoic acid is C11H12O2.
What is the molecular weight of (2Z)-2-benzylidenebutanoic acid?
The molecular weight of (2Z)-2-benzylidenebutanoic acid is 176.08 g/mol.
Where can I buy (2Z)-2-benzylidenebutanoic acid?
You can request a quote for (2Z)-2-benzylidenebutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z)-2-benzylidenebutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-2-benzylidenebutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.