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2,2-Diisopropyl-1,3-dioxolane structure
Fine Chemical

2,2-Diisopropyl-1,3-dioxolane

TL;DR: 2,2-Diisopropyl-1,3-dioxolane (CAS 4421-10-7) is a chemical compound with molecular formula C9H18O2 and molecular weight 158.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2,2-di(propan-2-yl)-1,3-dioxolane

Also Known As: 2,2-Diisopropyl-1,3-dioxolane, Diisopropyldioxolan, 2,2-di(propan-2-yl)-1,3-dioxolane, 1-testosterone Ethyl carbonate, 2,2-bis(propan-2-yl)-1,3-dioxolane

CAS Number
4421-10-7
Molecular Formula
C9H18O2
Molecular Weight
158.13068 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (6 patents) Organic Building Blocks (8 patents)

Technical Specifications

Molecular FormulaC9H18O2
Molecular Weight158.13068 g/mol
XLogP2.3
Topological Polar Surface Area (TPSA)18.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass158.13068 Da
Heavy Atoms11
Complexity114.0
SMILESCC(C)C1(OCCO1)C(C)C
InChIKeyBIYJJEWTEPSHGZ-UHFFFAOYSA-N

Chemical Property Profile of 2,2-Diisopropyl-1,3-dioxolane

XLogP
2.3
TPSA (Topological Polar Surface Area)
18.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
11
Complexity
114.0
Exact Mass
158.13068
Monoisotopic Mass
158.13068
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 2,2-Diisopropyl-1,3-dioxolane

The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Diisopropyl-1,3-dioxolane. With a topological polar surface area (TPSA) of 18.5 Ų, 2,2-Diisopropyl-1,3-dioxolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Diisopropyl-1,3-dioxolane 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

What is the CAS number of 2,2-Diisopropyl-1,3-dioxolane?

The CAS number of 2,2-Diisopropyl-1,3-dioxolane is 4421-10-7.

What is the molecular formula of 2,2-Diisopropyl-1,3-dioxolane?

The molecular formula of 2,2-Diisopropyl-1,3-dioxolane is C9H18O2.

What is the molecular weight of 2,2-Diisopropyl-1,3-dioxolane?

The molecular weight of 2,2-Diisopropyl-1,3-dioxolane is 158.13068 g/mol.

Where can I buy 2,2-Diisopropyl-1,3-dioxolane?

You can request a quote for 2,2-Diisopropyl-1,3-dioxolane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2,2-Diisopropyl-1,3-dioxolane?

Yes, CoreyChem provides custom synthesis services for 2,2-Diisopropyl-1,3-dioxolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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