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4-amino-1-methylpiperidine-4-carbonitrile , CAS No.11434991

COA

Grade & Purity:

≥98%

Cas Number: 123194-00-3
Molecular Weight: 139.20
MDL number: MFCD09739421
PubChem CID: 11434991

In stock

Item Number

A385886

Grouped product items
SKU	Size	Availability	Price	Qty
A385886-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$540.90
A385886-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,335.90

View related series

Fatty heterocyclic compounds (80) Piperidine compound (53)

Basic Description

Synonyms	FT-0706633 \| SCHEMBL1139876 \| EN300-31941 \| MFCD09739421 \| BS-13217 \| DTXSID10465686 \| YEA19400 \| Z247612626 \| AKOS000146240 \| 4-amino-4-cyano-1-methylpiperidine \| SB41951 \| 4-Piperidinecarbonitrile, 4-amino-1-methyl- \| 4-amino-1-methyl-piperidine-4-carbo
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Piperidines
    - Subclass Aminopiperidines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Piperidines
Subclass	Aminopiperidines
Intermediate Tree Nodes	Not available
Direct Parent	Aminopiperidines
Alternative Parents	Trialkylamines Alpha-aminonitriles Azacyclic compounds Monoalkylamines Hydrocarbon derivatives
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	4-aminopiperidine - Alpha-aminonitrile - Tertiary aliphatic amine - Tertiary amine - Azacycle - Nitrile - Carbonitrile - Organic nitrogen compound - Cyanide - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as aminopiperidines. These are compounds containing a piperidine that carries an amino group.
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	4-amino-1-methylpiperidine-4-carbonitrile
INCHI	InChI=1S/C7H13N3/c1-10-4-2-7(9,6-8)3-5-10/h2-5,9H2,1H3
InChIKey	HUTRESLXFRPBOW-UHFFFAOYSA-N
Smiles	CN1CCC(CC1)(C#N)N
Isomeric SMILES	CN1CCC(CC1)(C#N)N
Molecular Weight	139.20
Reaxy-Rn	11210074
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11210074&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	139.200 g/mol
XLogP3	-0.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	139.111 Da
Monoisotopic Mass	139.111 Da
Topological Polar Surface Area	53.100 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	159.000
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

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