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1,1-Dimethoxynon-2-yne structure
Fine Chemical

1,1-Dimethoxynon-2-yne

TL;DR: 1,1-Dimethoxynon-2-yne (CAS 13257-44-8) is a chemical compound with molecular formula C11H20O2 and molecular weight 184.14633 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,1-dimethoxynon-2-yne

Also Known As: Parmavert, 1,1-Dimethoxynon-2-yne, 2-nonynal dimethyl acetal, 2-Nonynal dimethylacetal, 2-Nonyne, 1,1-dimethoxy-

CAS Number
13257-44-8
Molecular Formula
C11H20O2
Molecular Weight
184.14633 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Food Additives (1 patents) Pharmaceutical Intermediates (5 patents) Surfactants & Detergents (1 patents)

Technical Specifications

Molecular FormulaC11H20O2
Molecular Weight184.14633 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)18.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds6
Exact Mass184.14633 Da
Heavy Atoms13
Complexity159.0
SMILESCCCCCCC#CC(OC)OC
InChIKeyRPJGIPAAHSGBEZ-UHFFFAOYSA-N

Chemical Property Profile of 1,1-Dimethoxynon-2-yne

XLogP
3.3
TPSA (Topological Polar Surface Area)
18.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
6
Heavy Atoms
13
Complexity
159.0
Exact Mass
184.14633
Monoisotopic Mass
184.14633
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 1,1-Dimethoxynon-2-yne

The XLogP value of 3.3 indicates that 1,1-Dimethoxynon-2-yne is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1,1-Dimethoxynon-2-yne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Dimethoxynon-2-yne 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 1,1-Dimethoxynon-2-yne?

The CAS number of 1,1-Dimethoxynon-2-yne is 13257-44-8.

What is the molecular formula of 1,1-Dimethoxynon-2-yne?

The molecular formula of 1,1-Dimethoxynon-2-yne is C11H20O2.

What is the molecular weight of 1,1-Dimethoxynon-2-yne?

The molecular weight of 1,1-Dimethoxynon-2-yne is 184.14633 g/mol.

Where can I buy 1,1-Dimethoxynon-2-yne?

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

Does CoreyChem offer custom synthesis for 1,1-Dimethoxynon-2-yne?

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

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