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2,6-Dibenzyloxybenzonitrile , CAS No.94088-47-8

COA

Grade & Purity:

≥98%

Cas Number: 94088-47-8
Molecular Weight: 315.37
PubChem CID: 3023483
PubChem SID: 488194190

In stock

Item Number

D357153

Grouped product items
SKU	Size	Availability	Price
D357153-10g	10g	5	$151.90
D357153-25g	25g	5	$339.90
D357153-50g	50g	4	$580.90

Discover 2,6-Dibenzyloxybenzonitrile by Aladdin Scientific in for only $151.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	E81618 \| 2,6-Bis(phenylmethoxy)benzonitrile \| AKOS015950789 \| 2,6-bis(benzyloxy)benzonitrile \| SCHEMBL5741190 \| 2,6-DIBENZYLOXYBENZONITRILE \| Benzonitrile,2,6-bis(phenylmethoxy)- \| EINECS 302-048-0 \| VMVKBYOKFOFDOD-UHFFFAOYSA-N \| FT-0610536 \| MFCD00016874
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenol ethers

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenol ethers
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Phenol ethers
Alternative Parents	Phenoxy compounds Benzonitriles Alkyl aryl ethers Nitriles Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenoxy compound - Phenol ether - Benzonitrile - Alkyl aryl ether - Monocyclic benzene moiety - Nitrile - Carbonitrile - Ether - Organic nitrogen compound - Organic oxygen compound - Cyanide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
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

Pubchem Sid	488194190
IUPAC Name	2,6-bis(phenylmethoxy)benzonitrile
INCHI	InChI=1S/C21H17NO2/c22-14-19-20(23-15-17-8-3-1-4-9-17)12-7-13-21(19)24-16-18-10-5-2-6-11-18/h1-13H,15-16H2
InChIKey	VMVKBYOKFOFDOD-UHFFFAOYSA-N
Smiles	C1=CC=C(C=C1)COC2=C(C(=CC=C2)OCC3=CC=CC=C3)C#N
Isomeric SMILES	C1=CC=C(C=C1)COC2=C(C(=CC=C2)OCC3=CC=CC=C3)C#N
Molecular Weight	315.37
Reaxy-Rn	2767023
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2767023&ln=

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

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

Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
H2229208	Certificate of Analysis	Jun 09, 2025	D357153
H2229319	Certificate of Analysis	Jun 09, 2025	D357153
H2229330	Certificate of Analysis	Jun 09, 2025	D357153

Chemical and Physical Properties

Melt Point(°C)	122-124° C
Molecular Weight	315.400 g/mol
XLogP3	4.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Exact Mass	315.126 Da
Monoisotopic Mass	315.126 Da
Topological Polar Surface Area	42.300 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	373.000
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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