3-Methyl-2-butanol - ≥98%(GC) , CAS No.598-75-4

CAS: 598-75-4 Cat. No.: M158745 Molecular Weight: 88.15 Beilstein Registry Number: 1718800 EC Number: 209-950-2
AVAILABLE TO ORDER
GRADE & PURITY ≥98%(GC)
Synonyms
1,2-Dimethyl-1-propanol | MFCD00065949 | SY047377 | 1,2-dimethylpropyl alcohol | DL-3-Methyl-2-butanol | (.+/-.)-3-Methyl-2-butanol | 3-METHYL-2-BUTANOL, (+/-)- | 1,2-Dimethylpropanol | 3-Methyl-(S)-2-Butanol | MFCD00004527 | NSC 71162 | FT-0604375 | Meth
Storage
Room temperature
Shipped In
FedEx DG Service
Size
Status
Price
Qty
5ml
M158745-5ml
9
$11.90
25ml
M158745-25ml
8
$31.90
100ml
M158745-100ml
9
$79.90
500ml
M158745-500ml
2
$204.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥98%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

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

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Quality documents

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

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

3-Methyl-2-butanol has been used as a reference for microbially produced, volatile organic compounds (MVOC) in GC-MS analyses

Specifications

Synonyms
1, 2-Dimethyl-1-propanol | MFCD00065949 | SY047377 | 1, 2-dimethylpropyl alcohol | DL-3-Methyl-2-butanol | (.+/-.)-3-Methyl-2-butanol | 3-METHYL-2-BUTANOL, (+/-)- | 1, 2-Dimethylpropanol | 3-Methyl-(S)-2-Butanol | MFCD00004527 | NSC 71162 | FT-0604375 | Meth
Specifications & Purity
≥98%(GC)
Storage
Room temperature
Shipped In
FedEx DG Service
Purity
≥98%(GC)
Names and Identifiers
Pubchem Sid488181416
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488181416
Canonical SmilesCC(C)C(C)O
IUPAC Name3-methylbutan-2-ol
InChIKeyMXLMTQWGSQIYOW-UHFFFAOYSA-N
INCHI1S/C5H12O/c1-4(2)5(3)6/h4-6H,1-3H3
Isomeric SMILES CC(C)C(C)O
WGK Germany 1
Molecular Weight 88.15
Beilstein 1718800
Reaxy-Rn 1718800
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1718800&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 secondary alcohol
3D Structure
Interactive Chemical Structure Model





Mechanisms of Action
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.

17 results found

Lot NumberCertificate TypeDateItem
J2128439Certificate of AnalysisAug 11, 2025 M158745
J2128438Certificate of AnalysisAug 11, 2025 M158745
J2128437Certificate of AnalysisAug 11, 2025 M158745
L2511355Certificate of AnalysisJun 27, 2024 M158745
L2511354Certificate of AnalysisJun 27, 2024 M158745
F2312840Certificate of AnalysisMay 29, 2023 M158745
F2312843Certificate of AnalysisMay 29, 2023 M158745
F2312863Certificate of AnalysisMay 29, 2023 M158745
F2312838Certificate of AnalysisMay 29, 2023 M158745
F2312837Certificate of AnalysisMay 29, 2023 M158745
D2320147Certificate of AnalysisNov 24, 2022 M158745
L2206560Certificate of AnalysisNov 24, 2022 M158745
L2206599Certificate of AnalysisNov 24, 2022 M158745
L2206661Certificate of AnalysisNov 24, 2022 M158745
L2206709Certificate of AnalysisNov 24, 2022 M158745
D2320137Certificate of AnalysisNov 24, 2022 M158745
D2320140Certificate of AnalysisNov 01, 2021 M158745

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Chemical and Physical Properties
SolubilityMiscible in Ether, Alcohols. Slightly soluble in water. (2.8g/100mL, 30°C)
Refractive Index1.409
Flash Point(°F)93.2 °F
Flash Point(°C)39°C
Boil Point(°C)112℃
Molecular Weight88.150 g/mol
XLogP31.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass88.0888 Da
Monoisotopic Mass88.0888 Da
Topological Polar Surface Area20.200 Ų
Heavy Atom Count6
Formal Charge0
Complexity32.900
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
Reviews

Customer Reviews

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