(S)-(+)-DBD-APy [=(S)-(+)-4-(N,N-Dimethylaminosulfonyl)-7-(3-aminopyrrolidin-1-yl)-2,1,3-benzoxadiazole] [HPLC Labeling Reagent for e.e. Determination] - ≥98%(HPLC) , CAS No.143112-50-9

CAS: 143112-50-9 Cat. No.: S161067 Peso molecular: 311.36 Número EC: 677-155-1 PubChem CID: 15682839
Disponible para pedir
GRADE & PURITY ≥98%(HPLC)
Synonyms
D88576 | 7-[(3S)-3-Aminopyrrolidin-1-yl]-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamide | (S)-(+)-4-(N,N-Dimethylaminosulfonyl)-7-(3-aminopyrrolidin-1-yl)benzofurazan | (S)-(+)-DBD-APy [=(S)-(+)-4-(N,N-Dimethylaminosulfonyl)-7-(3-aminopyrrolidin-1-yl)-2,
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
10mg
S161067-10mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

21,90US$

32,90US$
Guardar 11,00 US$ (33.43%)
100mg
S161067-100mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

107,90US$

161,90US$
Guardar 54,00 US$ (33.35%)
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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.

Specifications

Sinónimos
D88576 | 7-[(3S)-3-Aminopyrrolidin-1-yl]-N, N-dimethyl-2, 1, 3-benzoxadiazole-4-sulfonamide | (S)-(+)-4-(N, N-Dimethylaminosulfonyl)-7-(3-aminopyrrolidin-1-yl)benzofurazan | (S)-(+)-DBD-APy [=(S)-(+)-4-(N, N-Dimethylaminosulfonyl)-7-(3-aminopyrrolidin-1-yl)-2,
Especificaciones y pureza
≥98%(HPLC)
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥98%(HPLC)
Nombres e identificadores
Sonrisas canónicasCN(C)S(=O)(=O)C1=CC=C(C2=NON=C12)N3CCC(C3)N
IUPAC Name7-[(3S)-3-aminopyrrolidin-1-yl]-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamide
InChIKeySZJGHUNJZRXXCA-QMMMGPOBSA-N
INCHI1S/C12H17N5O3S/c1-16(2)21(18,19)10-4-3-9(11-12(10)15-20-14-11)17-6-5-8(13)7-17/h3-4,8H,5-7,13H2,1-2H3/t8-/m0/s1
Isómeros SMILES CN(C)S(=O)(=O)C1=CC=C(C2=NON=C12)N3CC[C@@H](C3)N
PubChem CID 15682839
Peso molecular 311.36

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
ClaseBenzoxadiazoles
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentBenzoxadiazoles
Alternative Parents Dialkylarylamines  Organosulfonamides  Benzenoids  Pyrrolidines  Heteroaromatic compounds  Furazans  Aminosulfonyl compounds  Oxacyclic compounds  Azacyclic compounds  Organic oxides  Monoalkylamines  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Benzoxadiazole - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Organosulfonic acid amide - Benzenoid - Heteroaromatic compound - Azole - Furazan - Oxadiazole - Aminosulfonyl compound - Pyrrolidine - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid or derivatives - Tertiary amine - Azacycle - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organonitrogen compound - Primary aliphatic amine - Organic oxide - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as benzoxadiazoles. These are organic compounds containing a benzene fused to an oxadiazole ring (a five-membered ring with two carbon atoms, one nitrogen atom, and one oxygen atom).
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
SensibilidadAir Sensitive
Rotación específica [α]6° (C=1,CH3CN)
Punto de fusión (°C)130 °C
Peso molecular311.360 g/mol
XLogP3-0.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Exact Mass311.105 Da
Monoisotopic Mass311.105 Da
Topological Polar Surface Area114.000 Ų
Heavy Atom Count21
Formal Charge0
Complexity480.000
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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