3-azabicyclo[3.2.0]heptane-2,4-dione - ≥97% , CAS No.1122-09-4

CAS: 1122-09-4 Cat. No.: A626917 Peso molecular: 125.12 PubChem CID: 352625
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
6TFY3FFP86 | J-500366 | NoName_608 | D72910 | UNII-6TFY3FFP86 | 3-azabicyclo[3.2.0]heptane-2,4-dione | 3-Azabicyclo(3.2.0)heptane-2,4-dione | NSC527272 | NSC-527272 | DTXSID80901485 | AKOS015840951 | EN300-374420 | 1,2-Cyclobutanedicarboximide | DTXSID103
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
A626917-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
573,90US$
5g
A626917-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
2.296,90US$
10g
A626917-10g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
4.547,90US$
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Why this grade

≥97% 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
6TFY3FFP86 | J-500366 | NoName_608 | D72910 | UNII-6TFY3FFP86 | 3-azabicyclo[3.2.0]heptane-2, 4-dione | 3-Azabicyclo(3.2.0)heptane-2, 4-dione | NSC527272 | NSC-527272 | DTXSID80901485 | AKOS015840951 | EN300-374420 | 1, 2-Cyclobutanedicarboximide | DTXSID103
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥97%
Nombres e identificadores
Sonrisas canónicasC1CC2C1C(=O)NC2=O
IUPAC Name3-azabicyclo[3.2.0]heptane-2,4-dione
InChIKeyWXTZWJOCJKKBJR-UHFFFAOYSA-N
INCHI1S/C6H7NO2/c8-5-3-1-2-4(3)6(9)7-5/h3-4H,1-2H2,(H,7,8,9)
Isómeros SMILES C1CC2C1C(=O)NC2=O
CAS alternativo 1122-09-4
PubChem CID 352625
Número NSC 527272
Peso molecular 125.12

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
ClaseLactams
SubclassCaprolactams
Intermediate Tree Nodes Not available
Direct ParentCaprolactams
Alternative Parents Azepanes  Pyrrolidine-2-ones  N-unsubstituted carboxylic acid imides  Dicarboximides  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic heteropolycyclic compounds
Substituents Caprolactam - Azepane - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide - Dicarboximide - Carboxylic acid imide, n-unsubstituted - Pyrrolidine - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Aliphatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as caprolactams. These are cyclic amides of caproic acid. Caproic acid is the carboxylic acid derived from hexane with the general formula C5H11COOH.
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 molecular125.130 g/mol
XLogP3-0.500
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass125.048 Da
Monoisotopic Mass125.048 Da
Topological Polar Surface Area46.200 Ų
Heavy Atom Count9
Formal Charge0
Complexity167.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
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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