2-Propanol-OD - ≥98 atom% D , CAS No.3979-51-9

CAS: 3979-51-9 Cat. No.: P472008 Formula: C3H7DO Molecular Weight: 61.1 EC Number: 223-616-3
AVAILABLE TO ORDER
GRADE & PURITY ≥98 atom% D
Synonyms
2-Propan(ol-d) | Isopropyl alcoh(ol-d) | Isopropanol-OD
Storage
Room temperature
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Size
Germany (EU)
USA*
Price
Qty
250mg
P472008-250mg
—
3 In stock
€34.62
1g
P472008-1g
—
3 In stock
€104.04
Enter a quantity for the sizes you want to add.
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Why this grade

≥98 atom% D for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Description

2-Propanol-OD can be used as a solvent in the study of:Solvation time (dynamics) of singlet carbene compounds.Reaction mechanism of benzophenone and/or acetone ketyl radicals with tirapazamine.

Specifications

Synonyms
2-Propan(ol-d) | Isopropyl alcoh(ol-d) | Isopropanol-OD
Specifications & Purity
≥98 atom% D
Storage
Room temperature
Purity
≥98 atom% D
Names and Identifiers
Pubchem Sid508808004
Canonical SmilesCC(C)O
IUPAC Name2-deuteriooxypropane
InChIKeyKFZMGEQAYNKOFK-QYKNYGDISA-N
INCHI1S/C3H8O/c1-3(2)4/h3-4H,1-2H3/i4D
Isomeric SMILES [2H]OC(C)C
Molecular Weight 61.1
Reaxy-Rn 635639
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=635639&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic oxygen compounds
ClassOrganooxygen compounds
SubclassAlcohols and polyols
Intermediate Tree Nodes Not available
Direct ParentSecondary alcohols
Alternative Parents Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Secondary alcohol - Hydrocarbon derivative - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as secondary alcohols. These are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl).
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot NumberCertificate TypeDateItem
C2429287Certificate of AnalysisMar 08, 2024 P472008
C2429288Certificate of AnalysisMar 08, 2024 P472008
C2429300Certificate of AnalysisMar 08, 2024 P472008
C2429301Certificate of AnalysisMar 08, 2024 P472008
Chemical and Physical Properties
Refractive Index1.3752 (lit.)
Boil Point(°C)82 °C (lit.)
Melt Point(°C)-90 °C (lit.)
Molecular Weight61.100 g/mol
XLogP30.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass61.0638 Da
Monoisotopic Mass61.0638 Da
Topological Polar Surface Area20.200 Ų
Heavy Atom Count4
Formal Charge0
Complexity10.800
Isotope Atom Count1
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
References
1. Pengqi Zhu, Mengting Gao, Jin Zhang, Zhiwei Wu, Ruiyi Wang, Yunwei Wang, Eric R. Waclawik, Zhanfeng Zheng.  (2020)  Synergistic interaction between Ru and MgAl-LDH support for efficient hydrogen transfer reduction of carbonyl compounds under visible light.  APPLIED CATALYSIS B-ENVIRONMENTAL,      [PMID:] [10.1016/j.apcatb.2020.119640]
Solution Calculators
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