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3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol structure
Fine Chemical

3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol

TL;DR: 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol (CAS 125331-94-4) is a chemical compound with molecular formula C15H22O and molecular weight 218.16707 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol

Also Known As: 3-Buten-2-ol, 4-[3a,4,5,6,7,7a-hexahydro-4,7-methano-1H-inden-5(or 6)-yl]-3-methyl-, 3-Buten-2-ol, 4-(3a,4,5,6,7,7a-hexahydro-4,7-methano-1H-inden-5(or 6)-yl)-3-methyl-, 3-Buten-2-ol, 4-[3a,4,5,6,7,7a-hexahydro- 4,7-methano-1H-inden-5(or 6)-yl]-3-methyl-

CAS Number
125331-94-4
Molecular Formula
C15H22O
Molecular Weight
218.16707 g/mol
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Technical Specifications

Molecular FormulaC15H22O
Molecular Weight218.16707 g/mol
XLogP3.5
Topological Polar Surface Area (TPSA)20.2 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors1
Rotatable Bonds2
Exact Mass218.16707 Da
Heavy Atoms16
Complexity341.0
SMILESCC(C(=CC1CC2CC1C3C2CC=C3)C)O
InChIKeyIJTGAABNKKQILC-UHFFFAOYSA-N

Chemical Property Profile of 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol

XLogP
3.5
TPSA (Topological Polar Surface Area)
20.2
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
Rotatable Bonds
2
Heavy Atoms
16
Complexity
341.0
Exact Mass
218.16707
Monoisotopic Mass
218.16707
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol

The XLogP value of 3.5 indicates that 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol?

The CAS number of 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol is 125331-94-4.

What is the molecular formula of 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol?

The molecular formula of 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol is C15H22O.

What is the molecular weight of 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol?

The molecular weight of 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol is 218.16707 g/mol.

Where can I buy 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol?

You can request a quote for 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol?

Yes, CoreyChem provides custom synthesis services for 3-Methyl-4-(8-tricyclo[5.2.1.02,6]dec-4-enyl)but-3-en-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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