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Allyl heptafluoroisopropyl ether structure
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Allyl heptafluoroisopropyl ether

TL;DR: Allyl heptafluoroisopropyl ether (CAS 150771-44-1) is a chemical compound with molecular formula C6H5F7O and molecular weight 226.02286 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,1,1,2,3,3,3-heptafluoro-2-prop-2-enoxypropane

Also Known As: Allyl heptafluoroisopropyl ether, Allyl perfluoroisopropyl ether, allylheptafluoroisopropylether, perfluoroisopropyl allyl ether, Allylheptafluoroisopropyl ether

CAS Number
150771-44-1
Molecular Formula
C6H5F7O
Molecular Weight
226.02286 g/mol
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Technical Specifications

Molecular FormulaC6H5F7O
Molecular Weight226.02286 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)9.2 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors8
Rotatable Bonds3
Exact Mass226.02286 Da
Heavy Atoms14
Complexity189.0
SMILESC=CCOC(C(F)(F)F)(C(F)(F)F)F
InChIKeyFXUHCQHWDACOKK-UHFFFAOYSA-N

Chemical Property Profile of Allyl heptafluoroisopropyl ether

XLogP
3.3
TPSA (Topological Polar Surface Area)
9.2
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
8
Rotatable Bonds
3
Heavy Atoms
14
Complexity
189.0
Exact Mass
226.02286
Monoisotopic Mass
226.02286
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 Allyl heptafluoroisopropyl ether

The XLogP value of 3.3 indicates that Allyl heptafluoroisopropyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Allyl heptafluoroisopropyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allyl heptafluoroisopropyl ether has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Allyl heptafluoroisopropyl ether?

The CAS number of Allyl heptafluoroisopropyl ether is 150771-44-1.

What is the molecular formula of Allyl heptafluoroisopropyl ether?

The molecular formula of Allyl heptafluoroisopropyl ether is C6H5F7O.

What is the molecular weight of Allyl heptafluoroisopropyl ether?

The molecular weight of Allyl heptafluoroisopropyl ether is 226.02286 g/mol.

Where can I buy Allyl heptafluoroisopropyl ether?

You can request a quote for Allyl heptafluoroisopropyl ether directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Allyl heptafluoroisopropyl ether?

Yes, CoreyChem provides custom synthesis services for Allyl heptafluoroisopropyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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