1-(Cyclobutylcarbonyl)-1,4-diazepane - Reagent grade , CAS No.926193-28-4

CAS: 926193-28-4 Cat. No.: C479765 Molecular Weight: 182.26
AVAILABLE TO ORDER
GRADE & PURITY Reagent Grade ? General reagent-grade purity suitable for most laboratory work. Use as a dependable default when no specific higher grade is required.
Synonyms
1-(Cyclobutylcarbonyl)-1,4-diazepane, AldrichCPR | F21212 | Cyclobutyl-[1,4]diazepan-1-ylmethanone | Cyclobutyl-[1,4]diazepan-1-yl-methanone | CAICECVBKBZCGO-UHFFFAOYSA-N | cyclobutyl(1,4-diazepan-1-yl)methanone | SCHEMBL1159331 | 1-(cyclobutyl carbonyl)-
Storage
Room temperature
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Size
Status
Price
Qty
1g
C479765-1g
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$509.90

$595.90
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Why this grade

Reagent grade Reagent Grade 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

Synonyms
1-(Cyclobutylcarbonyl)-1, 4-diazepane, AldrichCPR | F21212 | Cyclobutyl-[1, 4]diazepan-1-ylmethanone | Cyclobutyl-[1, 4]diazepan-1-yl-methanone | CAICECVBKBZCGO-UHFFFAOYSA-N | cyclobutyl(1, 4-diazepan-1-yl)methanone | SCHEMBL1159331 | 1-(cyclobutyl carbonyl)-
Specifications & Purity
Reagent grade
Storage
Room temperature
Grade
Reagent Grade
Names and Identifiers
Canonical SmilesC1CC(C1)C(=O)N2CCCNCC2
IUPAC Namecyclobutyl(1,4-diazepan-1-yl)methanone
InChIKeyCAICECVBKBZCGO-UHFFFAOYSA-N
INCHI1S/C10H18N2O/c13-10(9-3-1-4-9)12-7-2-5-11-6-8-12/h9,11H,1-8H2
Isomeric SMILES C1CC(C1)C(=O)N2CCCNCC2
Molecular Weight 182.26
Reaxy-Rn 19700818
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19700818&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

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✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 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
SuperclassOrganoheterocyclic compounds
ClassDiazepanes
Subclass1,4-diazepanes
Intermediate Tree Nodes Not available
Direct Parent1,4-diazepanes
Alternative Parents Tertiary carboxylic acid amides  Amino acids and derivatives  Dialkylamines  Azacyclic compounds  Organopnictogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic heteromonocyclic compounds
Substituents 1,4-diazepane - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Secondary amine - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Amine - Aliphatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as 1,4-diazepanes. These are diazepanes having the two nitrogen atoms at position 1 and 4 of the diazepane ring.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight182.260 g/mol
XLogP30.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass182.142 Da
Monoisotopic Mass182.142 Da
Topological Polar Surface Area32.299 Ų
Heavy Atom Count13
Formal Charge0
Complexity189.000
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
Documents & Articles
Solution Calculators
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