Hexanal, 3-(hydroxymethyl)-4-methyl-
TL;DR: Hexanal, 3-(hydroxymethyl)-4-methyl- (CAS 56805-30-2) is a chemical compound with molecular formula C8H16O2 and molecular weight 144.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(hydroxymethyl)-4-methylhexanal
Also Known As: 3-(Hydroxymethyl)-4-methylhexanal, Hexanal, 3-(hydroxymethyl)-4-methyl-, 3-(hydroxymethyl)-4-methyl-hexanal, 3-(Hydroxymethyl)-4-methylhexanal #
| Molecular Formula | C8H16O2 |
|---|---|
| Molecular Weight | 144.12 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 144.11504 |
| Heavy Atoms | 10 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 56805-30-2 |
|---|---|
| SMILES | CCC(C)C(CC=O)CO |
| InChIKey | FYAFWNBBQXQTHW-UHFFFAOYSA-N |
Product Overview
Hexanal, 3-(hydroxymethyl)-4-methyl- (CAS 56805-30-2), with molecular formula C8H16O2 and molecular weight 144.12 g/mol. IUPAC: 3-(hydroxymethyl)-4-methylhexanal.
Chemical Property Profile of Hexanal, 3-(hydroxymethyl)-4-methyl-
Property Insights of Hexanal, 3-(hydroxymethyl)-4-methyl-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexanal, 3-(hydroxymethyl)-4-methyl-. With a topological polar surface area (TPSA) of 37.3 Ų, Hexanal, 3-(hydroxymethyl)-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexanal, 3-(hydroxymethyl)-4-methyl- 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 Hexanal, 3-(hydroxymethyl)-4-methyl-?
The CAS number of Hexanal, 3-(hydroxymethyl)-4-methyl- is 56805-30-2.
What is the molecular formula of Hexanal, 3-(hydroxymethyl)-4-methyl-?
The molecular formula of Hexanal, 3-(hydroxymethyl)-4-methyl- is C8H16O2.
What is the molecular weight of Hexanal, 3-(hydroxymethyl)-4-methyl-?
The molecular weight of Hexanal, 3-(hydroxymethyl)-4-methyl- is 144.12 g/mol.
Where can I buy Hexanal, 3-(hydroxymethyl)-4-methyl-?
You can request a quote for Hexanal, 3-(hydroxymethyl)-4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexanal, 3-(hydroxymethyl)-4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Hexanal, 3-(hydroxymethyl)-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.