1,3-Dimethylpyrazole - ≥98%(GC) , CAS No.694-48-4

CAS: 694-48-4 Cat. No.: D154769 Peso molecular: 96.13 Número EC: 689-662-5
Disponible para pedir
GRADE & PURITY ≥98%(GC)
Synonyms
2,5-Dimethylpyrazole | 1,3-Dimethyl-1H-pyrazole # | PB27396 | 1,3-Dimethyl-1H-pyrazole | Q63398064 | SY017661 | Pyrazole,3-dimethyl- | Glycerol triundecanoate | alpha-Chloropinacolin | 1H-Pyrazole, 1,3-dimethyl- | BB 0253271 | HY-W002168 | 2,6-Dimethyl-4-
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
D154769-1g
9
9,90US$
5g
D154769-5g
3
10,90US$
25g
D154769-25g
1

16,90US$

25,90US$
Guardar 9,00 US$ (34.75%)
100g
D154769-100g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

56,90US$

85,90US$
Guardar 29,00 US$ (33.76%)
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Why this grade

≥98%(GC) 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.

Specifications

Sinónimos
2, 5-Dimethylpyrazole | 1, 3-Dimethyl-1H-pyrazole # | PB27396 | 1, 3-Dimethyl-1H-pyrazole | Q63398064 | SY017661 | Pyrazole, 3-dimethyl- | Glycerol triundecanoate | alpha-Chloropinacolin | 1H-Pyrazole, 1, 3-dimethyl- | BB 0253271 | HY-W002168 | 2, 6-Dimethyl-4-
Especificaciones y pureza
≥98%(GC)
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥98%(GC)
Nombres e identificadores
Pubchem Sid488185680
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488185680
Sonrisas canónicasCC1=NN(C=C1)C
IUPAC Name1,3-dimethylpyrazole
InChIKeyNODLZCJDRXTSJO-UHFFFAOYSA-N
INCHI1S/C5H8N2/c1-5-3-4-7(2)6-5/h3-4H,1-2H3
Isómeros SMILES CC1=NN(C=C1)C
Peso molecular 96.13
Reaxy-Rn 106417
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=106417&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
SuperclassOrganoheterocyclic compounds
ClaseAzoles
SubclassPyrazoles
Intermediate Tree Nodes Not available
Direct ParentPyrazoles
Alternative Parents Heteroaromatic compounds  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Heteroaromatic compound - Pyrazole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as pyrazoles. These are compounds containing a pyrazole ring, which is a five-member aromatic ring with two nitrogen atoms (at positions 1 and 2) and three carbon atoms.
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.

5 results found

Lot NumberCertificate TypeFechaArticulo
F2328080Certificate of AnalysisOct 18, 2022 D154769
L1824137Certificate of AnalysisOct 18, 2022 D154769
L1824135Certificate of AnalysisOct 18, 2022 D154769
D23061130Certificate of AnalysisOct 18, 2022 D154769
L1824134Certificate of AnalysisOct 18, 2022 D154769
Propiedades químicas y físicas
SolubilidadSoluble in Methanol
Índice de refracción1.47
Punto de inflamación (°C)39 °C
Punto de ebullición (°C)138°C(lit.)
Peso molecular96.130 g/mol
XLogP30.600
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass96.0687 Da
Monoisotopic Mass96.0687 Da
Topological Polar Surface Area17.800 Ų
Heavy Atom Count7
Formal Charge0
Complexity63.100
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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