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2-Naphthonitrile - 97%, high purity , CAS No.613-46-7

1 Citations

COA

Grade & Purity:

≥97%

Cas Number: 613-46-7
Molecular Weight: 153.18
Beilstein Registry Number: 9(3)3186
EC Number: 210-344-5
MDL number: MFCD00016807
PubChem CID: 11944
PubChem SID: 488181491

In stock

Item Number

N113458

Grouped product items
SKU	Size	Availability	Price
N113458-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$9.90
N113458-5g	5g	2	$36.90
N113458-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$89.90

View related series

Nitrogenous compounds (2445) Non heterocyclic block (8163)

Basic Description

Synonyms	AI3-00234 \| I(2)-Naphthonitril \| A833178 \| Z57899739 \| b-naphthonitrile \| DS-9432 \| EINECS 210-344-5 \| N0039 \| NAPHTHALENE-2-CARBONITRILE \| AH-034/11364159 \| InChI=1/C11H7N/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7 \| Naphthalene-2-carbonitrile, 97% \| NSC4169
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Naphthalenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Naphthalenes
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Naphthalenes
Alternative Parents	Nitriles Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic homopolycyclic compounds
Substituents	Naphthalene - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
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	488181491
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488181491
IUPAC Name	naphthalene-2-carbonitrile
INCHI	InChI=1S/C11H7N/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7H
InChIKey	AZKDTTQQTKDXLH-UHFFFAOYSA-N
Smiles	C1=CC=C2C=C(C=CC2=C1)C#N
Isomeric SMILES	C1=CC=C2C=C(C=CC2=C1)C#N
WGK Germany	3
RTECS	QL5976350
UN Number	3439
Molecular Weight	153.18
Beilstein	9(3)3186
Reaxy-Rn	1363868
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1363868&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

2 results found

Lot Number	Certificate Type	Date	Item
D2423308	Certificate of Analysis	Mar 15, 2024	N113458
F2214250	Certificate of Analysis	Jun 15, 2022	N113458

Chemical and Physical Properties

Solubility	Soluble in Methanol,Benzene
Boil Point(°C)	156°C
Melt Point(°C)	67°C
Molecular Weight	153.180 g/mol
XLogP3	3.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	153.058 Da
Monoisotopic Mass	153.058 Da
Topological Polar Surface Area	23.800 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	200.000
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

Citations of This Product

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