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1-Benzoyl-3-piperidinamine hydrochloride - 97%, high purity , CAS No.1158607-76-1

COA

Grade & Purity:

≥97%

Cas Number: 1158607-76-1
Molecular Weight: 240.73
MDL number: MFCD12026979
PubChem CID: 44120470

In stock

Item Number

B481321

Grouped product items
SKU	Size	Availability	Price
B481321-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$217.90
B481321-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$434.90
B481321-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$739.90

Basic Description

Synonyms	AKOS015846849 \| 1-Benzoyl-3-piperidinamine hydrochloride \| 1-benzoylpiperidin-3-amine hydrochloride \| 1-Benzoyl-3-piperidinaminehydrochloride \| 1158607-76-1 \| MFCD12026979 \| (3-aminopiperidin-1-yl)-phenylmethanone;hydrochloride \| 1-Benzoyl-3-piperidinamin
Specifications & Purity	≥97%
Legal Information	Product of ChemBridge Corp.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzoyl derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoyl derivatives
Intermediate Tree Nodes	Not available
Direct Parent	1-benzoylpiperidines
Alternative Parents	N-benzoylpiperidines Benzamides Aminopiperidines Tertiary carboxylic acid amides Tertiary amines Amino acids and derivatives Azacyclic compounds Organooxygen compounds Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	1-benzoylpiperidine - N-benzoylpiperidine - Benzamide - Benzoic acid or derivatives - N-acyl-piperidine - 3-aminopiperidine - Piperidine - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary amine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Amine - Organonitrogen compound - Organooxygen compound - Primary aliphatic amine - Primary amine - Hydrochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as 1-benzoylpiperidines. These are compounds containing a piperidine ring substituted at the 1-position with a benzoyl 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	(3-aminopiperidin-1-yl)-phenylmethanone;hydrochloride
INCHI	InChI=1S/C12H16N2O.ClH/c13-11-7-4-8-14(9-11)12(15)10-5-2-1-3-6-10;/h1-3,5-6,11H,4,7-9,13H2;1H
InChIKey	OOKGNGIDKDJFSC-UHFFFAOYSA-N
Smiles	C1CC(CN(C1)C(=O)C2=CC=CC=C2)N.Cl
Isomeric SMILES	C1CC(CN(C1)C(=O)C2=CC=CC=C2)N.Cl
Molecular Weight	240.73
Reaxy-Rn	47353059
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=47353059&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Sensitivity	Moisture sensitive.
Molecular Weight	240.730 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	240.103 Da
Monoisotopic Mass	240.103 Da
Topological Polar Surface Area	46.300 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	224.000
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	2

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