![Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]- structure](/static/products/5491/54911-85-2.webp)
Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-
TL;DR: Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]- (CAS 54911-85-2) is a chemical compound with molecular formula C9H16O3 and molecular weight 172.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(oxan-2-yloxy)butanal
Also Known As: 4-(oxan-2-yloxy)butanal, 4-Tetrahydropyranyloxy-butanal, 4-(2-oxanyloxy)butanal, Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-, 4-((Tetrahydro-2H-pyran-2-yl)oxy)butanal
| Molecular Formula | C9H16O3 |
|---|---|
| Molecular Weight | 172.11 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 172.10994 |
| Heavy Atoms | 12 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 54911-85-2 |
|---|---|
| SMILES | C1CCOC(C1)OCCCC=O |
| InChIKey | UWMPHMYUITTYTD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]- (CAS 54911-85-2), with molecular formula C9H16O3 and molecular weight 172.11 g/mol. IUPAC: 4-(oxan-2-yloxy)butanal.
Chemical Property Profile of Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-
Property Insights of Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-. With a topological polar surface area (TPSA) of 35.5 Ų, Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]- has 0 hydrogen bond donor(s) and 3 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 Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-?
The CAS number of Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]- is 54911-85-2.
What is the molecular formula of Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-?
The molecular formula of Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]- is C9H16O3.
What is the molecular weight of Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-?
The molecular weight of Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]- is 172.11 g/mol.
Where can I buy Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-?
You can request a quote for Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-?
Yes, KEHONG BIO provides custom synthesis services for Butanal, 4-[(tetrahydro-2H-pyran-2-yl)oxy]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.