二苯基乙醛
TL;DR: 二苯基乙醛 (CAS 947-91-1) is a chemical compound with molecular formula C14H12O and molecular weight 196.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二苯基乙醛
2,2-diphenylacetaldehyde
Also Known As: DIPHENYLACETALDEHYDE, 2,2-Diphenylacetaldehyde, Diphenylketen, Acetaldehyde, diphenyl-, Diphenylethanal
| Molecular Formula | C14H12O |
|---|---|
| Molecular Weight | 196.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 196.08882 |
| Heavy Atoms | 15 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 947-91-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C=O)C2=CC=CC=C2 |
| InChIKey | HLLGFGBLKOIZOM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二苯基乙醛 (CAS 947-91-1), with molecular formula C14H12O and molecular weight 196.09 g/mol. IUPAC: 2,2-diphenylacetaldehyde.
Chemical Property Profile of 二苯基乙醛
Property Insights of 二苯基乙醛
The XLogP value of 3.0 indicates that 二苯基乙醛 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 二苯基乙醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二苯基乙醛 has 0 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 二苯基乙醛?
The CAS number of 二苯基乙醛 is 947-91-1.
What is the molecular formula of 二苯基乙醛?
The molecular formula of 二苯基乙醛 is C14H12O.
What is the molecular weight of 二苯基乙醛?
The molecular weight of 二苯基乙醛 is 196.09 g/mol.
Where can I buy 二苯基乙醛?
You can request a quote for 二苯基乙醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二苯基乙醛?
Yes, KEHONG BIO provides custom synthesis services for 二苯基乙醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.