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2-Benzyl-2，7-diazaspiro[4.5]decane - ≥95%, high purity , CAS No.1086395-71-2

COA

Grade & Purity:

≥95%

Cas Number: 1086395-71-2
Molecular Weight: 230.35
PubChem CID: 46835435

In stock

Item Number

B732813

Grouped product items
SKU	Size	Availability	Price	Qty
B732813-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$916.90
B732813-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,331.90

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azaspirodecane derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azaspirodecane derivatives
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Azaspirodecane derivatives
Alternative Parents	Phenylmethylamines Benzylamines Aralkylamines Piperidines N-alkylpyrrolidines Trialkylamines Dialkylamines Azacyclic compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Azaspirodecane - Benzylamine - Phenylmethylamine - Aralkylamine - Monocyclic benzene moiety - Piperidine - N-alkylpyrrolidine - Benzenoid - Pyrrolidine - Tertiary amine - Tertiary aliphatic amine - Secondary amine - Azacycle - Secondary aliphatic amine - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as azaspirodecane derivatives. These are organic compounds containing a spirodecane moiety with at least one nitrogen atom.
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	2-benzyl-2,9-diazaspiro[4.5]decane
INCHI	InChI=1S/C15H22N2/c1-2-5-14(6-3-1)11-17-10-8-15(13-17)7-4-9-16-12-15/h1-3,5-6,16H,4,7-13H2
InChIKey	YLMCYUHQYITSIZ-UHFFFAOYSA-N
Smiles	C1CC2(CCN(C2)CC3=CC=CC=C3)CNC1
Isomeric SMILES	C1CC2(CCN(C2)CC3=CC=CC=C3)CNC1
PubChem CID	46835435
Molecular Weight	230.35

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	230.350 g/mol
XLogP3	2.100
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	230.178 Da
Monoisotopic Mass	230.178 Da
Topological Polar Surface Area	15.300 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	247.000
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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