Isobutyl formate - ≥95% , CAS No.542-55-2

CAS: 542-55-2 Cat. No.: I141415 Summenformel: C5H10O2 Molekulargewicht: 102.13 Beilstein Registry Number: 2,21 EG-Nummer: 208-818-1
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GRADE & PURITY ≥95%
Synonyms
FEMA 2197 | EINECS 208-818-1 | WLN: VHO1Y1&1 | FT-0627357 | ISOBUTYL FORMATE | Formic acid, isobutyl ester | ISOBUTYL FORMATE [MI] | Isobutyl formate [UN2393] [Flammable liquid] | Isobutyl formate, 97% | MFCD00003293 | AKOS015903490 | Isobutyl formate [U
Storage
Room temperature
Shipped In
FedEx DG Service
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Size
Deutschland (EU)
USA*
Price
Qty
25ml
I141415-25ml
—
2 Auf Lager
21,61€
100ml
I141415-100ml
—
3 Auf Lager
77,14€
500ml
I141415-500ml
—
2 Auf Lager
145,69€
Enter a quantity for the sizes you want to add.
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Why this grade

≥95% 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.

📋

Quality documents

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

📚

Literature proof

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

Specifications

Synonyme
FEMA 2197 | EINECS 208-818-1 | WLN: VHO1Y1&1 | FT-0627357 | ISOBUTYL FORMATE | Formic acid, isobutyl ester | ISOBUTYL FORMATE [MI] | Isobutyl formate [UN2393] [Flammable liquid] | Isobutyl formate, 97% | MFCD00003293 | AKOS015903490 | Isobutyl formate [U
Spezifikationen & Reinheit
≥95%
Storage
Room temperature
Verschickt in
FedEx DG Service
Reinheit
≥95%
Namen und Kennungen
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488181233
Kanonisches Lächeln
CC(C)COC=O
IUPAC Name
2-methylpropyl formate
InChIKey
AVMSWPWPYJVYKY-UHFFFAOYSA-N
INCHI
1S/C5H10O2/c1-5(2)3-7-4-6/h4-5H,3H2,1-2H3
Isomere SMILES
CC(C)COC=O
WGK Deutschland
2
RTECS
LQ8650000
UN-Nummer
2393
Verpackungsgruppe
II
Molekulargewicht
102.13
Beilstein
2,21
Reaxy-Rn
1738888
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1738888&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 acids and derivatives
KlasseCarboxylic acids and derivatives
SubclassCarboxylic acid derivatives
Intermediate Tree Nodes Not available
Direct ParentCarboxylic acid esters
Alternative Parents Monocarboxylic acids and derivatives  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Carboxylic acid ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group).
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
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.

7 results found

Lot NumberCertificate TypeDatumArtikel
G1804086Certificate of AnalysisFeb 05, 2026 I141415
G1804084Certificate of AnalysisFeb 05, 2026 I141415
L2107226Certificate of AnalysisSep 09, 2025 I141415
L2107228Certificate of AnalysisSep 09, 2025 I141415
E23291225Certificate of AnalysisJul 12, 2022 I141415
E23291232Certificate of AnalysisJul 12, 2022 I141415
E23291248Certificate of AnalysisJul 12, 2022 I141415
Chemische und physikalische Eigenschaften
LöslichkeitSoluble in water; Miscible with Alcohol,Ether
Brechungsindex1.39
Flammpunkt (°F)50°F
Flammpunkt (°C)10℃
Siedepunkt (°C)98°C
Schmelzpunkt (°C)-96°C
Molekulargewicht102.130 g/mol
XLogP31.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass102.068 Da
Monoisotopic Mass102.068 Da
Topological Polar Surface Area26.300 Ų
Heavy Atom Count7
Formal Charge0
Complexity50.000
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
Lösungsrechner
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