Name: 3-phenyloxetan-3-amine hydrochloride - ≥97% , CAS No.1211284-11-5
Price: 78.9 USD
Availability: InStock

Taxonomic Classification

Taxonomy Tree

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Clase	Organonitrogen compounds
Subclass	Amines
Intermediate Tree Nodes	Not available
Direct Parent	Aralkylamines
Alternative Parents	Benzene and substituted derivatives Oxetanes Oxacyclic compounds Dialkyl ethers Organopnictogen compounds Monoalkylamines Hydrochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Aralkylamine - Monocyclic benzene moiety - Benzenoid - Oxetane - Dialkyl ether - Ether - Organoheterocyclic compound - Oxacycle - Primary amine - Organopnictogen compound - Organooxygen compound - Primary aliphatic amine - Hydrocarbon derivative - Organic oxygen compound - Hydrochloride - Aromatic heteromonocyclic compound
Descripción	This compound belongs to the class of organic compounds known as aralkylamines. These are alkylamines in which the alkyl group is substituted at one carbon atom by an aromatic hydrocarbyl 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

Estructura 3D

Certificados (CoA, COO, BSE/TSE y tabla de análisis)

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

Analytical Chart:

Propiedades químicas y físicas

Peso molecular	185.650 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	185.061 Da
Monoisotopic Mass	185.061 Da
Topological Polar Surface Area	35.300 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	136.000
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	2

Calculadoras de soluciones

Determine the necessary mass, volume, or concentration for preparing a solution.

Determine the dilution needed to prepare a stock solution.

Reseñas

Sonrisas canónicas	C1C(CO1)(C2=CC=CC=C2)N.Cl
IUPAC Name	3-phenyloxetan-3-amine;hydrochloride
InChIKey	RWUQQOGOMYRSSK-UHFFFAOYSA-N
INCHI	1S/C9H11NO.ClH/c10-9(6-11-7-9)8-4-2-1-3-5-8;/h1-5H,6-7,10H2;1H
Isómeros SMILES	C1C(CO1)(C2=CC=CC=C2)N.Cl
PubChem CID	53256980
Peso molecular	185.65

3-phenyloxetan-3-amine hydrochloride - ≥97% , CAS No.1211284-11-5

Specifications