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1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione - ≥95%, high purity , CAS No.878-46-6

    Grade & Purity:
  • ≥95%
  • Cas Number:  878-46-6
  • Molecular Weight:  182.22
  • PubChem CID: 13423
In stock
Item Number
M693544
Grouped product items
SKU Size
Availability
Price Qty
M693544-1g
1g
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$321.90
M693544-5g
5g
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$930.90

Basic Description

Specifications & Purity ≥95%

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organoheterocyclic compounds
Class Azolidines
Subclass Imidazolidines
Intermediate Tree Nodes Imidazolidinones - Imidazolidinediones
Direct Parent Hydantoins
Alternative Parents Alpha amino acids and derivatives  N-acyl ureas  Dicarboximides  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular Framework Aliphatic heteropolycyclic compounds
Substituents Hydantoin - Alpha-amino acid or derivatives - N-acyl urea - Ureide - Dicarboximide - Urea - Carbonic acid derivative - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - 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

Product Properties

ALogP 0.7

Names and Identifiers

IUPAC Name 1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
INCHI InChI=1S/C9H14N2O2/c1-11-8(13)10-7(12)9(11)5-3-2-4-6-9/h2-6H2,1H3,(H,10,12,13)
InChIKey BVGOFWCNHZHTHW-UHFFFAOYSA-N
Smiles CN1C(=O)NC(=O)C12CCCCC2
Isomeric SMILES CN1C(=O)NC(=O)C12CCCCC2
PubChem CID 13423
Molecular Weight 182.22

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

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

Chemical and Physical Properties

Molecular Weight 182.220 g/mol
XLogP3 0.700
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 182.106 Da
Monoisotopic Mass 182.106 Da
Topological Polar Surface Area 49.400 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 256.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

Solution Calculators

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