2-(4-Nitro-1H-pyrazol-1-yl)ethanol - ≥95% , CAS No.42027-81-6

CAS: 42027-81-6 Cat. No.: E690632 Fórmula: C5H7N3O3 Peso molecular: 157.13 Número CE: 179-034-4 PubChem CID: 162055
Disponível para encomenda
GRADE & PURITY ≥95%
Synonyms
1-(2-Hydroxyethyl)-4-nitro-1H-pyrazole
Storage
Store at 2-8°C,Desiccated
Shipped In
Wet ice
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Size
Alemanha (EU)
USA*
Price
Qty
250mg
E690632-250mg
Sob encomenda · 8–12 semanas
17,27€
1g
E690632-1g
Sob encomenda · 8–12 semanas
48,51€
5g
E690632-5g
Sob encomenda · 8–12 semanas
216,85€
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Desiccated Ships Wet ice 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
1-(2-Hydroxyethyl)-4-nitro-1H-pyrazole
Especificações e pureza
≥95%
Condições de armazenamento de armazenamento
Store at 2-8°C,Desiccated
Enviado em
Wet ice
Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.
Pureza
≥95%
Propriedades do produto
ALogP
-0.7
Nomes e identificadores
Sorrisos canónicos
C1=C(C=NN1CCO)[N+](=O)[O-]
IUPAC Name
2-(4-nitropyrazol-1-yl)ethanol
InChIKey
WHPWNPMESFLXQT-UHFFFAOYSA-N
INCHI
1S/C5H7N3O3/c9-2-1-7-4-5(3-6-7)8(10)11/h3-4,9H,1-2H2
SMILES isoméricas
C1=C(C=NN1CCO)[N+](=O)[O-]
PubChem CID
162055
Peso molecular
157.13

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 1,3-dipolar compounds
ClasseAllyl-type 1,3-dipolar organic compounds
SubclassOrganic nitro compounds
Intermediate Tree Nodes C-nitro compounds
Direct ParentNitroaromatic compounds
Alternative Parents Pyrazoles  Heteroaromatic compounds  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Azacyclic compounds  Alkanolamines  Primary alcohols  Organopnictogen compounds  Organic zwitterions  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Nitroaromatic compound - Heteroaromatic compound - Pyrazole - Azole - Azacycle - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Alkanolamine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Primary alcohol - Organooxygen compound - Organonitrogen compound - Alcohol - Aromatic heteromonocyclic compound
DescriçãoThis compound belongs to the class of organic compounds known as nitroaromatic compounds. These are c-nitro compounds where the nitro group is C-substituted with an aromatic group.
External Descriptors Not available
Estrutura 3D
Modelo de Estrutura Química Interativa





Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propriedades químicas e físicas
Peso molecular157.130 g/mol
XLogP3-0.700
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass157.049 Da
Monoisotopic Mass157.049 Da
Topological Polar Surface Area83.900 Ų
Heavy Atom Count11
Formal Charge0
Complexity146.000
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 soluções
Revisões

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