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7-Methylindole-3-carboxaldehyde - 98%, high purity , CAS No.4771-50-0

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7-Methylindole-3-carboxaldehyde - 98%, high purity , CAS No.4771-50-0

COA

Grade & Purity:

≥98%

Cas Number: 4771-50-0
Molecular Weight: 159.18
MDL number: MFCD00047170
PubChem CID: 260389

In stock

Item Number

M123432

Grouped product items
SKU	Size	Availability	Price
M123432-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$9.90
M123432-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$19.90
M123432-5g	5g	1	$62.90
M123432-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$219.90

View related series

Fungal (844) Indole (3)

Basic Description

Synonyms	3-Carboxaldehyde, 7-methylindole- \| AKOS005206800 \| A15587 \| EN300-1275516 \| 7-Methylindole-3-aldehyde \| 3-Formyl-7-methylindole \| 7-Methylindole-3-carboxyaldehyde \| DS-0060 \| DTXSID20293694 \| FT-0621463 \| methyl5-(difluoromethoxy)-2-methylbenzoate \| NSC9
Specifications & Purity	≥98%
Storage Temp	Store at -20°C,Argon charged
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	Reactant for preparation of: 1.Tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulators. 2.Antibacterial and antituberculosis agents. 3.Antiandrogens effective against androgen receptor mutants. 4.Anti-bovine viral diarrhea virus (BVDV) agents. 5. Receptor subtype 5 antagonists. 6.Glucocorticoid receptor ligands. 7.Necroptosis inhibitors. 8. Orally efficacious small-molecule sctivator of the insulin receptor.

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 Vinylogous amides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Indole - Aryl-aldehyde - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Vinylogous amide - Azacycle - Aldehyde - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - 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

Associated Targets(Human)

TRIM24 Tchem Transcription intermediary factor 1-alpha (2 Activities)

Discover Target: TRIM24

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

TRIM33 Tchem E3 ubiquitin-protein ligase TRIM33 (2 Activities)

Discover Target: TRIM33

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

TRIM33 Tchem E3 ubiquitin-protein ligase TRIM33 (162 Activities)

Discover Target: TRIM33

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	7-methyl-1H-indole-3-carbaldehyde
INCHI	InChI=1S/C10H9NO/c1-7-3-2-4-9-8(6-12)5-11-10(7)9/h2-6,11H,1H3
InChIKey	KTUFZHVVJBHGKZ-UHFFFAOYSA-N
Smiles	CC1=C2C(=CC=C1)C(=CN2)C=O
Isomeric SMILES	CC1=C2C(=CC=C1)C(=CN2)C=O
WGK Germany	3
Molecular Weight	159.18
Reaxy-Rn	122340
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=122340&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.

8 results found

Lot Number	Certificate Type	Date	Item
I2424233	Certificate of Analysis	Aug 13, 2024	M123432
I2423396	Certificate of Analysis	Aug 13, 2024	M123432
I2423394	Certificate of Analysis	Aug 13, 2024	M123432
I2423397	Certificate of Analysis	Aug 13, 2024	M123432
I2423398	Certificate of Analysis	Aug 13, 2024	M123432
I2423395	Certificate of Analysis	Aug 13, 2024	M123432
I2423428	Certificate of Analysis	Aug 13, 2024	M123432
I2423429	Certificate of Analysis	Aug 13, 2024	M123432

Chemical and Physical Properties

Sensitivity	Air Sensitive
Melt Point(°C)	209-211°C
Molecular Weight	159.180 g/mol
XLogP3	1.900
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	159.068 Da
Monoisotopic Mass	159.068 Da
Topological Polar Surface Area	32.900 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	181.000
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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