3-(Trimethylsilyl)propynoic acid - ≥95% , CAS No.5683-31-8

CAS: 5683-31-8 Cat. No.: T124546 Molecular Weight: 142.23 Beilstein Registry Number: 1755674 EC Number: 628-042-0 PubChem CID: 2760863
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Synonyms
SCHEMBL1285864 | 3-(trimethylsilyl)prop-2-ynoic acid | 3-(Trimethylsilyl)propargylic Acid | MFCD00190216 | 3-(Trimethylsilyl)propynoic acid | FT-0651711 | TMS-propynoic acid | 2-Propynoic acid, 3-(trimethylsilyl)- | 3-trimethylsilylprop-2-ynoic Acid | A83
Storage
Room temperature
Shipped In
Normal
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Size
Status
Price
Qty
100mg
T124546-100mg
3

$15.90

$23.90
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1g
T124546-1g
1

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$35.90
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5g
T124546-5g
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$97.90

$146.90
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Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal 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-(Trimethylsilyl)propynoic acid may be used in the regioselective preparation of 1,5-trisubstituted 1H-1,2,3-triazoles.

Specifications

Synonyms
SCHEMBL1285864 | 3-(trimethylsilyl)prop-2-ynoic acid | 3-(Trimethylsilyl)propargylic Acid | MFCD00190216 | 3-(Trimethylsilyl)propynoic acid | FT-0651711 | TMS-propynoic acid | 2-Propynoic acid, 3-(trimethylsilyl)- | 3-trimethylsilylprop-2-ynoic Acid | A83
Specifications & Purity
≥95%
Storage
Room temperature
Shipped In
Normal
Purity
≥95%
Names and Identifiers
Pubchem Sid504761587
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504761587
Canonical SmilesC[Si](C)(C)C#CC(=O)O
IUPAC Name3-trimethylsilylprop-2-ynoic acid
InChIKeyIPEATTYBFBRNEB-UHFFFAOYSA-N
INCHI1S/C6H10O2Si/c1-9(2,3)5-4-6(7)8/h1-3H3,(H,7,8)
Isomeric SMILES C[Si](C)(C)C#CC(=O)O
WGK Germany 3
PubChem CID 2760863
Molecular Weight 142.23
Beilstein 1755674

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.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganometallic compounds
ClassOrganometalloid compounds
SubclassOrganosilicon compounds
Intermediate Tree Nodes Alkylsilanes
Direct ParentTrialkylsilanes
Alternative Parents Organic metalloid salts  Monocarboxylic acids and derivatives  Carboxylic acids  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Trialkylsilane - Organic metalloid salt - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as trialkylsilanes. These are organosilicon compounds containing exactly one alkyl chain attached to the silicon atom.
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.

2 results found

Lot NumberCertificate TypeDateItem
H2323036Certificate of AnalysisAug 30, 2023 T124546
H2323037Certificate of AnalysisAug 28, 2023 T124546
Chemical and Physical Properties
Flash Point(°F)96 °C
Flash Point(°C)96°C
Boil Point(°C)105-110°C
Melt Point(°C)47-49°C
Molecular Weight142.230 g/mol
XLogP3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass142.045 Da
Monoisotopic Mass142.045 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count9
Formal Charge0
Complexity176.000
Isotope Atom Count0
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
Solution Calculators
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