Ethyl 2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetate - ≥95% , CAS No.356790-62-0

CAS: 356790-62-0 Cat. No.: E692756 Peso molecular: 246.26 PubChem CID: 655517
Disponible para pedir
GRADE & PURITY ≥95%
Storage
Room temperature
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
250mg
E692756-250mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

1.014,90US$

1.183,90US$
Guardar 169,00 US$ (14.27%)
1g
E692756-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

2.028,90US$

2.366,90US$
Guardar 338,00 US$ (14.28%)
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Why this grade

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

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Storage & shipping

Room temperature Ships 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

Especificaciones y pureza
≥95%
Condiciones de almacenamiento de almacenamiento
Room temperature
Pureza
≥95%
Propiedades del producto
ALogP1.6
Nombres e identificadores
Sonrisas canónicasCCOC(=O)CC1=NN(C(=O)C2=CC=CC=C21)C
IUPAC Nameethyl 2-(3-methyl-4-oxophthalazin-1-yl)acetate
InChIKeyMOQFTWAPXKWBLW-UHFFFAOYSA-N
INCHI1S/C13H14N2O3/c1-3-18-12(16)8-11-9-6-4-5-7-10(9)13(17)15(2)14-11/h4-7H,3,8H2,1-2H3
Isómeros SMILES CCOC(=O)CC1=NN(C(=O)C2=CC=CC=C21)C
PubChem CID 655517
Peso molecular 246.26

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
ClaseDiazanaphthalenes
SubclassBenzodiazines
Intermediate Tree Nodes Phthalazines
Direct ParentPhthalazinones
Alternative Parents Pyridazinones  Benzenoids  Heteroaromatic compounds  Lactams  Carboxylic acid esters  Monocarboxylic acids and derivatives  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Phthalazinone - Pyridazinone - Pyridazine - Benzenoid - Heteroaromatic compound - Lactam - Carboxylic acid ester - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as phthalazinones. These are compounds containing a phthalazine bearing a ketone group.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





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Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Peso molecular246.260 g/mol
XLogP31.600
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass246.1 Da
Monoisotopic Mass246.1 Da
Topological Polar Surface Area59.000 Ų
Heavy Atom Count18
Formal Charge0
Complexity378.000
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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