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2-Formyl-1H-indole-6-carbonitrile - 96%, high purity , CAS No.104291-63-6

COA

Grade & Purity:

≥96%

Cas Number: 104291-63-6
Molecular Weight: 170.17
PubChem CID: 13567960

In stock

Item Number

F189471

Grouped product items
SKU	Size	Availability	Price
F189471-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$45.90
F189471-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$188.90
F189471-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$678.90

Discover 2-Formyl-1H-indole-6-carbonitrile by Aladdin Scientific in 96% for only $45.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	2-Formyl-1H-indole-6-carbonitrile \| 104291-63-6 \| DTXSID00544010 \| MFCD12924835 \| AKOS016007445 \| DS-17344 \| CS-0043777 \| N13179 \| A896253
Specifications & Purity	≥96%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Indoles and derivatives
    - Subclass Indoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Indoles and derivatives
Subclass	Indoles
Intermediate Tree Nodes	Not available
Direct Parent	Indoles
Alternative Parents	Aryl-aldehydes Substituted pyrroles Benzenoids Heteroaromatic compounds Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Indole - Aryl-aldehyde - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Carbonitrile - Nitrile - Azacycle - Cyanide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aldehyde - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
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

IUPAC Name	2-formyl-1H-indole-6-carbonitrile
INCHI	InChI=1S/C10H6N2O/c11-5-7-1-2-8-4-9(6-13)12-10(8)3-7/h1-4,6,12H
InChIKey	GZRGVNQOBGZODJ-UHFFFAOYSA-N
Smiles	C1=CC2=C(C=C1C#N)NC(=C2)C=O
Isomeric SMILES	C1=CC2=C(C=C1C#N)NC(=C2)C=O
Molecular Weight	170.17
Reaxy-Rn	4988503
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4988503&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	170.170 g/mol
XLogP3	1.600
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	170.048 Da
Monoisotopic Mass	170.048 Da
Topological Polar Surface Area	56.700 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	255.000
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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