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ALPHA-PHENYL-4-MORPHOLINEACETONITRILE , CAS No.15190-10-0

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ALPHA-PHENYL-4-MORPHOLINEACETONITRILE , CAS No.15190-10-0

COA

Cas Number: 15190-10-0
Molecular Weight: 202.258
PubChem CID: 85812

In stock

Item Number

A167469

Grouped product items
SKU	Size	Availability	Price
A167469-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$9.90
A167469-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$41.90
A167469-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$135.90

Basic Description

Synonyms	2-(morpholin-4-yl)-2-phenylacetonitrile \| morpholin-4-yl(phenyl)acetonitrile \| NSC75643 \| NSC-75643 \| ALPHA-(4-MORPHOLINYL)PHENYLACETONITRILE \| HMS2752G24 \| Morpholino(phenyl)acetonitrile \| EINECS 239-242-9 \| NCGC00246591-01 \| 8G-016 \| MB00240 \| NSC 75643
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Amines

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Amines
Intermediate Tree Nodes	Not available
Direct Parent	Aralkylamines
Alternative Parents	Morpholines Benzene and substituted derivatives Trialkylamines Alpha-aminonitriles Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Aralkylamine - Monocyclic benzene moiety - Morpholine - Oxazinane - Benzenoid - Alpha-aminonitrile - Tertiary amine - Tertiary aliphatic amine - Dialkyl ether - Ether - Carbonitrile - Nitrile - Oxacycle - Organoheterocyclic compound - Azacycle - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description	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

Associated Targets(non-human)

Plasmodium falciparum (966862 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	2-morpholin-4-yl-2-phenylacetonitrile
INCHI	InChI=1S/C12H14N2O/c13-10-12(11-4-2-1-3-5-11)14-6-8-15-9-7-14/h1-5,12H,6-9H2
InChIKey	MWZPYQLYZXTCLZ-UHFFFAOYSA-N
Smiles	C1COCCN1C(C#N)C2=CC=CC=C2
Isomeric SMILES	C1COCCN1C(C#N)C2=CC=CC=C2
Molecular Weight	202.258
Reaxy-Rn	181704
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=181704&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	202.250 g/mol
XLogP3	1.400
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	202.111 Da
Monoisotopic Mass	202.111 Da
Topological Polar Surface Area	36.300 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	233.000
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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