4-Methyl-4-heptanol - ≥98% , CAS No.598-01-6

CAS: 598-01-6 Cat. No.: M157913 Peso molecular: 130.23 Beilstein Registry Number: 1(4)1789 Número EC: 620-952-6
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
UY4L629D4F | FT-0692548 | MFCD00021840 | NCIOpen2_000458 | SCHEMBL308585 | 4-Methyl-4-heptanol | DTXSID60208525 | NSC 71544 | M0954 | D91412 | IQXKGRKRIRMQCQ-UHFFFAOYSA-N | AKOS024429419 | 4-Heptanol, 4-methyl- | NSC71544 | NSC-71544 | 4-Hydroxy-4-methylh
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1ml
M157913-1ml
3
36,90US$
5ml
M157913-5ml
2
182,90US$
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥98% 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
UY4L629D4F | FT-0692548 | MFCD00021840 | NCIOpen2_000458 | SCHEMBL308585 | 4-Methyl-4-heptanol | DTXSID60208525 | NSC 71544 | M0954 | D91412 | IQXKGRKRIRMQCQ-UHFFFAOYSA-N | AKOS024429419 | 4-Heptanol, 4-methyl- | NSC71544 | NSC-71544 | 4-Hydroxy-4-methylh
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥98%
Nombres e identificadores
Pubchem Sid488187871
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488187871
Sonrisas canónicasCCCC(C)(CCC)O
IUPAC Name4-methylheptan-4-ol
InChIKeyIQXKGRKRIRMQCQ-UHFFFAOYSA-N
INCHI1S/C8H18O/c1-4-6-8(3,9)7-5-2/h9H,4-7H2,1-3H3
Isómeros SMILES CCCC(C)(CCC)O
Peso molecular 130.23
Beilstein 1(4)1789
Reaxy-Rn 1732735
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1732735&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
SubclassAlcohols and polyols
Intermediate Tree Nodes Not available
Direct ParentTertiary alcohols
Alternative Parents Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Tertiary alcohol - Hydrocarbon derivative - Aliphatic acyclic compound
DescripciónThis compound belongs to the class of organic compounds known as tertiary alcohols. These are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (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.

4 results found

Lot NumberCertificate TypeFechaArticulo
H2316143Certificate of AnalysisAug 01, 2023 M157913
H2316144Certificate of AnalysisAug 01, 2023 M157913
H2316145Certificate of AnalysisAug 01, 2023 M157913
H2316146Certificate of AnalysisAug 01, 2023 M157913
Propiedades químicas y físicas
Índice de refracción1.43
Punto de inflamación (°F)52°C(lit.)
Punto de inflamación (°C)52°C(lit.)
Punto de ebullición (°C)62°C/12mmHg
Peso molecular130.229 g/mol
XLogP32.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass130.136 Da
Monoisotopic Mass130.136 Da
Topological Polar Surface Area20.200 Ų
Heavy Atom Count9
Formal Charge0
Complexity63.000
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
Calculadoras de soluciones
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