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3-Quinolinecarbonitrile - ≥98% , CAS No.34846-64-5

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3-Quinolinecarbonitrile - ≥98% CAS No(34846-64-5) by Aladdin Scientific

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AVAILABLE TO ORDER

GRADE & PURITY ≥98%

Synonyms

SB36763 | Quinoline-3-nitrile | J-019781 | AC-8732 | BDBM50526481 | EN300-51131 | 3-Quinolinecarbonitrile | NSC44644 | NSC-44644 | Quinolin-3-carbonitrile | SY066101 | AKOS004910368 | 6GHZ8PDL63 | SCHEMBL63442 | KDV | 3-Quinolinecarbonitrile, 98% | BBL103

Storage

Room temperature

Shipped In

Normal

Specifications Names and Identifiers Documentation Advanced Data Taxonomic Classification 3D Structure Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solution Calculators Reviews

Specifications

Synonyms

Specifications & Purity

≥98%

Storage

Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

Pubchem Sid	504756176
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504756176
Canonical Smiles	C1=CC=C2C(=C1)C=C(C=N2)C#N
IUPAC Name	quinoline-3-carbonitrile
InChIKey	QZZYYBQGTSGDPP-UHFFFAOYSA-N
INCHI	1S/C10H6N2/c11-6-8-5-9-3-1-2-4-10(9)12-7-8/h1-5,7H
Isomeric SMILES	C1=CC=C2C(=C1)C=C(C=N2)C#N
WGK Germany	3
PubChem CID	93177
Molecular Weight	154.17

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

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✅ Certificate of Analysis (COA)

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📊 Datasheet

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Quinolines and derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Quinolines and derivatives
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Quinolines and derivatives
Alternative Parents	Pyridines and derivatives Benzenoids Heteroaromatic compounds Nitriles Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Quinoline - Benzenoid - Pyridine - Heteroaromatic compound - Azacycle - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as quinolines and derivatives. These are compounds containing a quinoline moiety, which consists of a benzene ring fused to a pyrimidine ring to form benzo[b]azabenzene.
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

3D Structure

Mechanisms of Action

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.

3 results found

Lot Number	Certificate Type	Date	Item
K2103249	Certificate of Analysis	Aug 11, 2025	Q103605
K2103266	Certificate of Analysis	Aug 11, 2025	Q103605
K2103269	Certificate of Analysis	Aug 11, 2025	Q103605

Chemical and Physical Properties

Melt Point(°C)	108-110°C
Molecular Weight	154.170 g/mol
XLogP3	1.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	154.053 Da
Monoisotopic Mass	154.053 Da
Topological Polar Surface Area	36.700 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	203.000
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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