![7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one structure](/static/products/774/77412-76-1.png)
7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one
TL;DR: 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one (CAS 77412-76-1) is a chemical compound with molecular formula C16H24O2 and molecular weight 248.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aR,6aS,7R,10aS)-7-methyl-7-prop-2-enyl-3,3a,4,5,6,6a,9,10-octahydro-1H-benzo[d][2]benzofuran-8-one
Also Known As: 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one, (3aR,6aS,7R,10aS)-7-methyl-7-prop-2-enyl-3,3a,4,5,6,6a,9,10-octahydro-1H-benzo[d][2]benzofuran-8-one
| Molecular Formula | C16H24O2 |
|---|---|
| Molecular Weight | 248.18 g/mol |
| LogP | 3.3646 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.17763 |
| Heavy Atoms | 18 |
| Complexity | 375.29324 |
Chemical Identifiers
| CAS Number | 77412-76-1 |
|---|---|
| SMILES | C[C@]1([C@H]2CCC[C@@H]3[C@@]2(CCC1=O)COC3)CC=C |
Product Overview
7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one (CAS 77412-76-1), with molecular formula C16H24O2 and molecular weight 248.18 g/mol. IUPAC: (3aR,6aS,7R,10aS)-7-methyl-7-prop-2-enyl-3,3a,4,5,6,6a,9,10-octahydro-1H-benzo[d][2]benzofuran-8-one.
Chemical Property Profile of 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one
Property Insights of 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one
The XLogP value of 3.3646 indicates that 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one has 0 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 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one?
The CAS number of 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one is 77412-76-1.
What is the molecular formula of 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one?
The molecular formula of 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one is C16H24O2.
What is the molecular weight of 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one?
The molecular weight of 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one is 248.18 g/mol.
Where can I buy 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one?
You can request a quote for 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 7-allyl-7-methyloctahydronaphtho[1,8a-c]furan-8(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.