(S)-2-Amino-4-(7-hydroxy-2-oxo-2H-chromen-4-yl)butanoic acid - ≥98%(HPLC) , CAS No.905442-42-4

CAS: 905442-42-4 Cat. No.: A770737 Peso molecular: 263.25 PubChem CID: 57523941
Disponible para pedir
GRADE & PURITY ≥98%(HPLC)
Storage
Room temperature
Shipped In
Normal
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Size
Estado
Price
Qty
50mg
A770737-50mg
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572,90US$
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Why this grade

≥98%(HPLC) 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.

Descripción general

The courmarin-based unnatural amino acid is an effective fluorophore; which has been incoporated into several studies of protein interactions.

Specifications

Especificaciones y pureza
≥98%(HPLC)
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥98%(HPLC)
Nombres e identificadores
Sonrisas canónicasC1=CC2=C(C=C1O)OC(=O)C=C2CCC(C(=O)O)N
IUPAC Name(2S)-2-amino-4-(7-hydroxy-2-oxochromen-4-yl)butanoic acid
InChIKeyQEQAKQQRJFWPOR-JTQLQIEISA-N
INCHI1S/C13H13NO5/c14-10(13(17)18)4-1-7-5-12(16)19-11-6-8(15)2-3-9(7)11/h2-3,5-6,10,15H,1,4,14H2,(H,17,18)/t10-/m0/s1
Isómeros SMILES C1=CC2=C(C=C1O)OC(=O)C=C2CC[C@@H](C(=O)O)N
PubChem CID 57523941
Peso molecular 263.25

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.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassPhenylpropanoids and polyketides
ClaseCoumarins and derivatives
SubclassHydroxycoumarins
Intermediate Tree Nodes Not available
Direct Parent7-hydroxycoumarins
Alternative Parents L-alpha-amino acids  1-benzopyrans  Pyranones and derivatives  Aralkylamines  1-hydroxy-2-unsubstituted benzenoids  Heteroaromatic compounds  Lactones  Amino acids  Oxacyclic compounds  Monocarboxylic acids and derivatives  Carboxylic acids  Organic oxides  Monoalkylamines  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents 7-hydroxycoumarin - Alpha-amino acid - Alpha-amino acid or derivatives - L-alpha-amino acid - Benzopyran - 1-benzopyran - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Pyranone - Phenol - Benzenoid - Pyran - Heteroaromatic compound - Amino acid - Amino acid or derivatives - Lactone - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Amine - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Primary amine - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as 7-hydroxycoumarins. These are coumarins that contain one or more hydroxyl groups attached to the C7 position the coumarin skeleton.
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:
Propiedades químicas y físicas
Peso molecular263.250 g/mol
XLogP3-1.400
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass263.079 Da
Monoisotopic Mass263.079 Da
Topological Polar Surface Area110.000 Ų
Heavy Atom Count19
Formal Charge0
Complexity406.000
Isotope Atom Count0
Defined Atom Stereocenter Count1
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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