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6-Hydroxy-4-methylcoumarin - >98.0%(GC), high purity , CAS No.2373-31-1

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6-Hydroxy-4-methylcoumarin - >98.0%(GC), high purity , CAS No.2373-31-1

COA

Grade & Purity:

≥98%(GC)

Cas Number: 2373-31-1
Molecular Weight: 176.17
MDL number: MFCD00016967
PubChem CID: 75409
PubChem SID: 504754942

In stock

Item Number

H156924

Grouped product items
SKU	Size	Availability	Price
H156924-1g	1g	10	$9.90
H156924-5g	5g	1	$29.90
H156924-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$114.90

View related series

Phenylpropanoids (153) Six-Membered Heterocyclic Compounds (1696)

Basic Description

Synonyms	DSSTox_CID_7923 \| H1005 \| H10797 \| 8-chlorosulfonylquinoline \| SR-01000452777-1 \| 6-Hydroxy-4-methyl-2-benzopyrone \| A878157 \| HY-N6658 \| 1-Methyl-6-hydroxy-cumarin \| 6-hydroxy-4-methyl-2H-chromen-2-one \| EINECS 219-146-3 \| S9330 \| GN69998000 \| J-015196 \|
Specifications & Purity	≥98%(GC)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Phenylpropanoids and polyketides
  - Class Coumarins and derivatives
    - Subclass Hydroxycoumarins

Kingdom	Organic compounds
Superclass	Phenylpropanoids and polyketides
Class	Coumarins and derivatives
Subclass	Hydroxycoumarins
Intermediate Tree Nodes	Not available
Direct Parent	Hydroxycoumarins
Alternative Parents	1-benzopyrans Pyranones and derivatives 1-hydroxy-2-unsubstituted benzenoids Heteroaromatic compounds Lactones Oxacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Hydroxycoumarin - Benzopyran - 1-benzopyran - 1-hydroxy-2-unsubstituted benzenoid - Pyranone - Benzenoid - Pyran - Heteroaromatic compound - Lactone - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as hydroxycoumarins. These are coumarins that contain one or more hydroxyl groups attached to the coumarin skeleton.
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)

AKR1B1 Tclin Aldose reductase (1404 Activities)

Discover Target: AKR1B1

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

MTOR Tclin Serine/threonine-protein kinase mTOR (13850 Activities)

Discover Target: MTOR

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

Pubchem Sid	504754942
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504754942
IUPAC Name	6-hydroxy-4-methylchromen-2-one
INCHI	InChI=1S/C10H8O3/c1-6-4-10(12)13-9-3-2-7(11)5-8(6)9/h2-5,11H,1H3
InChIKey	IRUHWRSITUYICV-UHFFFAOYSA-N
Smiles	CC1=CC(=O)OC2=C1C=C(C=C2)O
Isomeric SMILES	CC1=CC(=O)OC2=C1C=C(C=C2)O
Molecular Weight	176.17
Reaxy-Rn	144873
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=144873&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
C1904105	Certificate of Analysis	Dec 12, 2022	H156924
G2321080	Certificate of Analysis	Dec 12, 2022	H156924

Chemical and Physical Properties

Melt Point(°C)	248 °C
Molecular Weight	176.170 g/mol
XLogP3	1.900
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	176.047 Da
Monoisotopic Mass	176.047 Da
Topological Polar Surface Area	46.500 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	257.000
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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