cis-2-Methyl-5-isopropylhexa-2,5-dienal
TL;DR: cis-2-Methyl-5-isopropylhexa-2,5-dienal (CAS 112077-94-8) is a chemical compound with molecular formula C10H16O and molecular weight 152.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2,6-dimethyl-5-methylidenehept-2-enal
Also Known As: Isonovalal, Novalal, cis-2-Methyl-5-isopropylhexa-2,5-dienal, (Z)-2-Methyl-5-isopropylhexa-2,5-dienal, 2-Methyl-5-isopropylhexa-2Z,5-dienal
| Molecular Formula | C10H16O |
|---|---|
| Molecular Weight | 152.12 g/mol |
| LogP | 2.7339 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 152.12012 |
| Heavy Atoms | 11 |
| Complexity | 175.3118 |
Chemical Identifiers
| CAS Number | 112077-94-8 |
|---|---|
| SMILES | CC(C)C(=C)C/C=C(/C)\C=O |
Product Overview
cis-2-Methyl-5-isopropylhexa-2,5-dienal (CAS 112077-94-8), with molecular formula C10H16O and molecular weight 152.12 g/mol. IUPAC: (Z)-2,6-dimethyl-5-methylidenehept-2-enal.
Chemical Property Profile of cis-2-Methyl-5-isopropylhexa-2,5-dienal
Property Insights of cis-2-Methyl-5-isopropylhexa-2,5-dienal
The XLogP value of 2.7339 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-2-Methyl-5-isopropylhexa-2,5-dienal. With a topological polar surface area (TPSA) of 17.07 Ų, cis-2-Methyl-5-isopropylhexa-2,5-dienal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-2-Methyl-5-isopropylhexa-2,5-dienal 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 cis-2-Methyl-5-isopropylhexa-2,5-dienal?
The CAS number of cis-2-Methyl-5-isopropylhexa-2,5-dienal is 112077-94-8.
What is the molecular formula of cis-2-Methyl-5-isopropylhexa-2,5-dienal?
The molecular formula of cis-2-Methyl-5-isopropylhexa-2,5-dienal is C10H16O.
What is the molecular weight of cis-2-Methyl-5-isopropylhexa-2,5-dienal?
The molecular weight of cis-2-Methyl-5-isopropylhexa-2,5-dienal is 152.12 g/mol.
Where can I buy cis-2-Methyl-5-isopropylhexa-2,5-dienal?
You can request a quote for cis-2-Methyl-5-isopropylhexa-2,5-dienal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-2-Methyl-5-isopropylhexa-2,5-dienal?
Yes, KEHONG BIO provides custom synthesis services for cis-2-Methyl-5-isopropylhexa-2,5-dienal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.