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Isopropylethanediol structure
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Isopropylethanediol

TL;DR: Isopropylethanediol (CAS 109-59-1) is a chemical compound with molecular formula C5H12O2 and molecular weight 104.08373 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-propan-2-yloxyethanol

Also Known As: 2-Isopropoxyethanol, Isopropyl oxitol, Dowanal EiPAT, Isopropyl glycol, Isopropyl cellosolve

CAS Number
109-59-1
Molecular Formula
C5H12O2
Molecular Weight
104.08373 g/mol
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Application Areas

Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (204 patents) Analytical Reagents (23 patents) Biotechnology (16 patents) Catalysts (47 patents) Coatings & Adhesives (623 patents)

Technical Specifications

Molecular FormulaC5H12O2
Molecular Weight104.08373 g/mol
XLogP0.1
Topological Polar Surface Area (TPSA)29.5 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds3
Exact Mass104.08373 Da
Heavy Atoms7
Complexity35.0
Melting Point-60 °C
Boiling Point285.8 °F at 760 mmHg (USCG, 1999)
Density0.91 (USCG, 1999) - Less dense than water; will float
Flash Point91.4 °F (USCG, 1999)
Vapor Pressure3 mmHg (NIOSH, 2024)
Refractive IndexINDEX OF REFRACTION: 1.4095 @ 20 °C/D
SolubilityMiscible (NIOSH, 2024)
SMILESCC(C)OCCO
InChIKeyHCGFUIQPSOCUHI-UHFFFAOYSA-N

Product Description

Applications: Isopropylethanediol is used in imaging, photographic, and photosensitive formulations, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Isopropylethanediol (CAS 109-59-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Isopropylethanediol (CAS 109-59-1) is a photographic chemical with the molecular formula C5H12O2 and a molecular weight of 104.08 g/mol. Key physical properties include a density of 0.91 (USCG, 1999) - Less dense than water; will float g/cm³, a solubility: Miscible (NIOSH, 2024). It is also known as 2-Isopropoxyethanol and Isopropyl oxitol.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Isopropylethanediol

XLogP
0.1
TPSA (Topological Polar Surface Area)
29.5
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
3
Heavy Atoms
7
Complexity
35.0
Exact Mass
104.08373
Monoisotopic Mass
104.08373
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 Isopropylethanediol

The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropylethanediol. With a topological polar surface area (TPSA) of 29.5 Ų, Isopropylethanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropylethanediol has 1 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 Isopropylethanediol?

The CAS number of Isopropylethanediol is 109-59-1.

What is the molecular formula of Isopropylethanediol?

The molecular formula of Isopropylethanediol is C5H12O2.

What is the molecular weight of Isopropylethanediol?

The molecular weight of Isopropylethanediol is 104.08373 g/mol.

What are the applications of Isopropylethanediol?

Isopropylethanediol is used in imaging, photographic, and photosensitive formulations, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Isopropylethanediol (CAS 109-59-1) with custom...

Where can I buy Isopropylethanediol?

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

Does CoreyChem offer custom synthesis for Isopropylethanediol?

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

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