Trimethyl orthovalerate - ≥97% , CAS No.13820-09-2

CAS: 13820-09-2 Cat. No.: T107300 Peso molecular: 162.23 Beilstein Registry Number: 1739200 Número EC: 237-496-5 PubChem CID: 83755
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
DTXSID4065654 | SCHEMBL594044 | UNII-W0X9MOM6VZ | MFCD00008481 | Trimethyl orthovalerate purum | EINECS 237-496-5 | methyl orthovalerate | ortho-n-Valeric acid trimethyl ester | Orthovaleric Acid Trimethyl Ester | 1,1,1-Trimethoxy-n-pentan | Trimethylorth
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5ml
T107300-5ml
1
13,90US$
25ml
T107300-25ml
2
35,90US$
100ml
T107300-100ml
2
102,90US$
250ml
T107300-250ml
2
189,90US$
500ml
T107300-500ml
2
303,90US$
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal 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

Sinónimos
DTXSID4065654 | SCHEMBL594044 | UNII-W0X9MOM6VZ | MFCD00008481 | Trimethyl orthovalerate purum | EINECS 237-496-5 | methyl orthovalerate | ortho-n-Valeric acid trimethyl ester | Orthovaleric Acid Trimethyl Ester | 1, 1, 1-Trimethoxy-n-pentan | Trimethylorth
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥97%
Nombres e identificadores
Pubchem Sid504755720
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504755720
Sonrisas canónicasCCCCC(OC)(OC)OC
IUPAC Name1,1,1-trimethoxypentane
InChIKeyXUXVVQKJULMMKX-UHFFFAOYSA-N
INCHI1S/C8H18O3/c1-5-6-7-8(9-2,10-3)11-4/h5-7H2,1-4H3
Isómeros SMILES CCCCC(OC)(OC)OC
WGK Alemania 3
PubChem CID 83755
Número ONU 3272
Peso molecular 162.23
Beilstein 1739200
Reaxy-Rn 1739200

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
ClaseOrganooxygen compounds
SubclassOrtho esters
Intermediate Tree Nodes Not available
Direct ParentOrtho esters
Alternative Parents Carboxylic acid orthoesters  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Ortho ester - Carboxylic acid orthoester - Orthocarboxylic acid derivative - Hydrocarbon derivative - Aliphatic acyclic compound
DescripciónThis compound belongs to the class of organic compounds known as ortho esters. These are compounds having the general structure RC(OR')3 ( R' not H), or the structure C(OR')4 ( R' not H).
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
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.

12 results found

Lot NumberCertificate TypeFechaArticulo
J1520115Certificate of AnalysisJul 07, 2023 T107300
J2231017Certificate of AnalysisNov 01, 2022 T107300
J2231020Certificate of AnalysisNov 01, 2022 T107300
J2231021Certificate of AnalysisNov 01, 2022 T107300
J2231022Certificate of AnalysisNov 01, 2022 T107300
J2231023Certificate of AnalysisNov 01, 2022 T107300
C2631019Certificate of AnalysisSep 28, 2022 T107300
E2310916Certificate of AnalysisSep 28, 2022 T107300
E2310921Certificate of AnalysisSep 28, 2022 T107300
E2310927Certificate of AnalysisSep 28, 2022 T107300
E2310929Certificate of AnalysisSep 28, 2022 T107300
E2310960Certificate of AnalysisSep 28, 2022 T107300

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Propiedades químicas y físicas
SensibilidadMoisture sensitive.
Índice de refracción1.41
Punto de inflamación (°F)107.6 °F
Punto de inflamación (°C)42 °C
Punto de ebullición (°C)164-166°C
Peso molecular162.230 g/mol
XLogP31.700
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass162.126 Da
Monoisotopic Mass162.126 Da
Topological Polar Surface Area27.700 Ų
Heavy Atom Count11
Formal Charge0
Complexity81.100
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
Calculadoras de soluciones
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