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1,3,7-triazaspiro[4.5]decane-2,4-dione - 97%, high purity , CAS No.78222-09-0

COA

Grade & Purity:

≥97%

Cas Number: 78222-09-0
Molecular Weight: 169.18
EC Number: 886-461-6
MDL number: MFCD07776799
PubChem CID: 12652263

In stock

Item Number

T634538

Grouped product items
SKU	Size	Availability	Price
T634538-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$125.90
T634538-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$179.90
T634538-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$721.90
T634538-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,441.90

Basic Description

Synonyms	1,3,9-triazaspiro[4.5]decane-2,4-dione \| Z905065822 \| AS-50526 \| CS-0055732 \| 1,3,7-Triaza-spiro[45]decane-2,4-dione \| FT-0655009 \| MFCD07776799 \| Allylsalicylate \| SCHEMBL3332022 \| 1,3,7-TRIAZA-SPIRO[4,5]DECANE-2,4-DIONE \| EN300-88977 \| 2,4,9-triazaspiro
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azolidines
    - Subclass Imidazolidines
      - Level5 Imidazolidinones
        Level6 Imidazolidinediones
        Level7 Hydantoins

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azolidines
Subclass	Imidazolidines
Intermediate Tree Nodes	Imidazolidinones - Imidazolidinediones
Direct Parent	Hydantoins
Alternative Parents	Azaspirodecane derivatives Alpha amino acids and derivatives 5-monosubstituted hydantoins N-acyl ureas Piperidines Dicarboximides Dialkylamines Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic heteropolycyclic compounds
Substituents	Hydantoin - Alpha-amino acid or derivatives - Azaspirodecane - 5-monosubstituted hydantoin - N-acyl urea - Ureide - Piperidine - Dicarboximide - Amino acid or derivatives - Urea - Carbonic acid derivative - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Secondary amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aliphatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as hydantoins. These are heterocyclic compounds containing an imidazolidine substituted by ketone group at positions 2 and 4.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	1,3,9-triazaspiro[4.5]decane-2,4-dione
INCHI	InChI=1S/C7H11N3O2/c11-5-7(10-6(12)9-5)2-1-3-8-4-7/h8H,1-4H2,(H2,9,10,11,12)
InChIKey	PLFDWSDBRBNQLQ-UHFFFAOYSA-N
Smiles	C1CC2(CNC1)C(=O)NC(=O)N2
Isomeric SMILES	C1CC2(CNC1)C(=O)NC(=O)N2
Alternate CAS	78222-09-0
PubChem CID	12652263
Molecular Weight	169.18

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	169.180 g/mol
XLogP3	-1.100
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	169.085 Da
Monoisotopic Mass	169.085 Da
Topological Polar Surface Area	70.200 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	241.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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