苯甲醛二甲缩醛
TL;DR: 苯甲醛二甲缩醛 (CAS 1125-88-8) is a chemical compound with molecular formula C9H12O2 and molecular weight 152.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯甲醛二甲缩醛
dimethoxymethylbenzene
Also Known As: Benzaldehyde dimethyl acetal, (dimethoxymethyl)benzene, Dimethoxymethylbenzene, Dimethoxyphenylmethane, alpha,alpha-Dimethoxytoluene
| Molecular Formula | C9H12O2 |
|---|---|
| Molecular Weight | 152.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 152.08372 |
| Heavy Atoms | 11 |
| Complexity | 93.0 |
| Boiling Point | 87.00 to 89.00 °C. @ 18.00 mm Hg |
| Density | 1.007-1.020 |
| Solubility | insoluble in water; soluble in organic solvents, oils |
| Refractive Index | 1.488-1.496 |
Chemical Identifiers
| CAS Number | 1125-88-8 |
|---|---|
| SMILES | COC(C1=CC=CC=C1)OC |
| InChIKey | HEVMDQBCAHEHDY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苯甲醛二甲缩醛 (CAS 1125-88-8), with molecular formula C9H12O2 and molecular weight 152.08 g/mol. IUPAC: dimethoxymethylbenzene.
Chemical Property Profile of 苯甲醛二甲缩醛
Property Insights of 苯甲醛二甲缩醛
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 苯甲醛二甲缩醛. With a topological polar surface area (TPSA) of 18.5 Ų, 苯甲醛二甲缩醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苯甲醛二甲缩醛 has 0 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 苯甲醛二甲缩醛?
The CAS number of 苯甲醛二甲缩醛 is 1125-88-8.
What is the molecular formula of 苯甲醛二甲缩醛?
The molecular formula of 苯甲醛二甲缩醛 is C9H12O2.
What is the molecular weight of 苯甲醛二甲缩醛?
The molecular weight of 苯甲醛二甲缩醛 is 152.08 g/mol.
Where can I buy 苯甲醛二甲缩醛?
You can request a quote for 苯甲醛二甲缩醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯甲醛二甲缩醛?
Yes, KEHONG BIO provides custom synthesis services for 苯甲醛二甲缩醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.