2,5-Dimethyl-3-hexanone - ≥96% , CAS No.1888-57-9

CAS: 1888-57-9 Cat. No.: D154365 Peso molecular: 128.22 Número EC: 679-747-5
Disponible para pedir
GRADE & PURITY ≥96%
Synonyms
3-Hexanone, 2,5-dimethyl- (8CI)(9CI) | TUIWMHDSXJWXOH-UHFFFAOYSA- | 3-Hexanone, 2,5-dimethyl- | NSC940 | NSC-940 | (-)-ISOBORNEOLACETICACID | UNII-S52D4H3T92 | DTXSID30172249 | S52D4H3T92 | 2,5-DIMETHYL-3-HEXANONE | AKOS009157574 | T70480 | 3-Hexanone,5-d
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1ml
D154365-1ml
2
205,90US$
5ml
D154365-5ml
3
554,90US$
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥96% 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
3-Hexanone, 2, 5-dimethyl- (8CI)(9CI) | TUIWMHDSXJWXOH-UHFFFAOYSA- | 3-Hexanone, 2, 5-dimethyl- | NSC940 | NSC-940 | (-)-ISOBORNEOLACETICACID | UNII-S52D4H3T92 | DTXSID30172249 | S52D4H3T92 | 2, 5-DIMETHYL-3-HEXANONE | AKOS009157574 | T70480 | 3-Hexanone, 5-d
Especificaciones y pureza
≥96%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥96%
Nombres e identificadores
Pubchem Sid504752719
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504752719
Sonrisas canónicasCC(C)CC(=O)C(C)C
IUPAC Name2,5-dimethylhexan-3-one
InChIKeyTUIWMHDSXJWXOH-UHFFFAOYSA-N
INCHI1S/C8H16O/c1-6(2)5-8(9)7(3)4/h6-7H,5H2,1-4H3
Isómeros SMILES CC(C)CC(=O)C(C)C
Peso molecular 128.22
Reaxy-Rn 1741768
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1741768&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
ClaseOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Not available
Direct ParentKetones
Alternative Parents Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Ketone - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
DescripciónThis compound belongs to the class of organic compounds known as ketones. These are organic compounds in which a carbonyl group is bonded to two carbon atoms R2C=O (neither R may be a hydrogen atom). Ketones that have one or more alpha-hydrogen atoms undergo keto-enol tautomerization, the tautomer being an enol.
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.

2 results found

Lot NumberCertificate TypeFechaArticulo
B23211161Certificate of AnalysisJan 03, 2023 D154365
B2321305Certificate of AnalysisJan 03, 2023 D154365
Propiedades químicas y físicas
Índice de refracción1.41
Punto de ebullición (°C)148°C
Peso molecular128.210 g/mol
XLogP32.300
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass128.12 Da
Monoisotopic Mass128.12 Da
Topological Polar Surface Area17.100 Ų
Heavy Atom Count9
Formal Charge0
Complexity92.700
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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