Α-甲基肉桂醛
TL;DR: Α-甲基肉桂醛 (CAS 101-39-3) is a chemical compound with molecular formula C10H10O and molecular weight 146.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Α-甲基肉桂醛
2-methyl-3-phenylprop-2-enal
Also Known As: ALPHA-METHYLCINNAMALDEHYDE, methylcinnamaldehyde, 2-methylcinnamic aldehyde, a-Methylcinnamaldehyde, alpha-Methylcinnimal
| Molecular Formula | C10H10O |
|---|---|
| Molecular Weight | 146.07 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 146.07317 |
| Heavy Atoms | 11 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 101-39-3 |
|---|---|
| SMILES | CC(=CC1=CC=CC=C1)C=O |
| InChIKey | VLUMOWNVWOXZAU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Α-甲基肉桂醛 (CAS 101-39-3), with molecular formula C10H10O and molecular weight 146.07 g/mol. IUPAC: 2-methyl-3-phenylprop-2-enal.
Chemical Property Profile of Α-甲基肉桂醛
Property Insights of Α-甲基肉桂醛
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Α-甲基肉桂醛. With a topological polar surface area (TPSA) of 17.1 Ų, Α-甲基肉桂醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Α-甲基肉桂醛 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 Α-甲基肉桂醛?
The CAS number of Α-甲基肉桂醛 is 101-39-3.
What is the molecular formula of Α-甲基肉桂醛?
The molecular formula of Α-甲基肉桂醛 is C10H10O.
What is the molecular weight of Α-甲基肉桂醛?
The molecular weight of Α-甲基肉桂醛 is 146.07 g/mol.
Where can I buy Α-甲基肉桂醛?
You can request a quote for Α-甲基肉桂醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Α-甲基肉桂醛?
Yes, KEHONG BIO provides custom synthesis services for Α-甲基肉桂醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.