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5-Ethyl-2-methylpyridine borane complex , CAS No.1014979-56-6

COA

Cas Number: 1014979-56-6
Molecular Weight: 135.01
MDL number: MFCD16621137
PubChem CID: 25053227

In stock

Item Number

E488220

Grouped product items
SKU	Size	Availability	Price
E488220-25ml	25ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$264.90
E488220-50ml	50ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$348.90
E488220-100ml	100ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$791.90
E488220-500ml	500ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$4,151.90

Basic Description

Synonyms	MFCD16621137 \| 5-Ethyl-2-picoline Borane \| 1014979-56-6 \| 5-ETHYL-2-METHYLPYRIDINE BORANE \| SCHEMBL487256 \| A904001 \| MNMBLEICNIBHKB-UHFFFAOYSA-N \| 1006873-58-0 \| AKOS015891848 \| J-517470 \| B4084
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	Description Reactant for:Organometallic cross-coupling reactionsReductive amination

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Methylpyridines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Methylpyridines
Intermediate Tree Nodes	Not available
Direct Parent	Methylpyridines
Alternative Parents	Heteroaromatic compounds Organic metalloid salts Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Methylpyridine - Heteroaromatic compound - Azacycle - Organic metalloid salt - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as methylpyridines. These are organic compounds containing a pyridine ring substituted at one or more positions by a methyl 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

INCHI	InChI=1S/C8H11N.B/c1-3-8-5-4-7(2)9-6-8;/h4-6H,3H2,1-2H3;
InChIKey	VPEPQDBAIMZCGV-UHFFFAOYSA-N
Smiles	[B].CCC1=CN=C(C=C1)C
Isomeric SMILES	[B].CCC1=CN=C(C=C1)C
WGK Germany	3
PubChem CID	25053227
Molecular Weight	135.01
Reaxy-Rn	13125553

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

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

Analytical Chart:

Chemical and Physical Properties

Flash Point(°F)	221 °F
Flash Point(°C)	105 °C
Molecular Weight	131.990 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	132.098 Da
Monoisotopic Mass	132.098 Da
Topological Polar Surface Area	12.900 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	80.600
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

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