trans-1-(1-Adamantyl)propene
TL;DR: trans-1-(1-Adamantyl)propene (CAS 150587-69-2) is a chemical compound with molecular formula C13H20 and molecular weight 176.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-prop-1-enyladamantane
Also Known As: 1-(1-adamantyl)propene, trans-1-(1-adamantyl)propene, 1-[(1E)-prop-1-en-1-yl]adamantane, (E)-1-(Prop-1-en-1-yl)adamantane, 1-[(E)-prop-1-enyl]adamantane
| Molecular Formula | C13H20 |
|---|---|
| Molecular Weight | 176.16 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.1565 |
| Heavy Atoms | 13 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 150587-69-2 |
|---|---|
| SMILES | CC=CC12CC3CC(C1)CC(C3)C2 |
| InChIKey | KJONNQZAPZNSNI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
trans-1-(1-Adamantyl)propene (CAS 150587-69-2), with molecular formula C13H20 and molecular weight 176.16 g/mol. IUPAC: 1-prop-1-enyladamantane.
Chemical Property Profile of trans-1-(1-Adamantyl)propene
Property Insights of trans-1-(1-Adamantyl)propene
The XLogP value of 4.7 indicates that trans-1-(1-Adamantyl)propene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, trans-1-(1-Adamantyl)propene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-1-(1-Adamantyl)propene has 0 hydrogen bond donor(s) and 0 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 trans-1-(1-Adamantyl)propene?
The CAS number of trans-1-(1-Adamantyl)propene is 150587-69-2.
What is the molecular formula of trans-1-(1-Adamantyl)propene?
The molecular formula of trans-1-(1-Adamantyl)propene is C13H20.
What is the molecular weight of trans-1-(1-Adamantyl)propene?
The molecular weight of trans-1-(1-Adamantyl)propene is 176.16 g/mol.
Where can I buy trans-1-(1-Adamantyl)propene?
You can request a quote for trans-1-(1-Adamantyl)propene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-1-(1-Adamantyl)propene?
Yes, KEHONG BIO provides custom synthesis services for trans-1-(1-Adamantyl)propene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.