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Structure

5,7-Dihydroxy-4-Methylcoumarin

CAS
2107-76-8
Catalog Number
ACM2107768-1
Category
Inhibitors
Molecular Weight
192.17
Molecular Formula
C10H8O4

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Specification

Description
5,7-Dihydroxy-4-methylcoumarin is a coumarin derivative from Mexican tarragon. 5,7-Dihydroxy-4-methylcoumarin possesses antifungal and antibacterial activities.
Synonyms
4-Methyllimetol
IUPAC Name
5,7-Dihydroxy-4-methylchromen-2-one
Canonical SMILES
CC1=CC(=O)OC2=CC(=CC(=C12)O)O
InChI
InChI=1S/C10H8O4/c1-5-2-9(13)14-8-4-6(11)3-7(12)10(5)8/h2-4,11-12H,1H3
InChI Key
QNVWGEJMXOQQPM-UHFFFAOYSA-N
Boiling Point
472.1±14.0 °C
Melting Point
296-299 °C(lit.)
Flash Point
197.8 °C
Density
1.456±0.06 g/cm³
Solubility
Soluble in sodium hydroxide
Appearance
Solid
Storage
-20 °C Freezer, under inert atmosphere
Complexity
284
Exact Mass
192.04225873
Hazard Statements
Xi
Monoisotopic Mass
192.04225873
pKa
7.29±0.20(Predicted)
Refractive Index
1.651
Safety Description
26-36
Shipping
Can be shipped at room temperature, where not in use may vary.
Source
Plantsother families
Supplemental Hazard Statements
H315-H319-H335
Symbol
GHS07
Topological Polar Surface Area
66.8 Ų
What is the molecular formula of 5,7-Dihydroxy-4-methylcoumarin?

The molecular formula of 5,7-Dihydroxy-4-methylcoumarin is C10H8O4.

What is the molecular weight of 5,7-Dihydroxy-4-methylcoumarin?

The molecular weight of 5,7-Dihydroxy-4-methylcoumarin is 192.17 g/mol.

What are the synonyms of 5,7-Dihydroxy-4-methylcoumarin?

The synonyms of 5,7-Dihydroxy-4-methylcoumarin are 5,7-DIHYDROXY-4-METHYLCOUMARIN, 2107-76-8, 5,7-Dihydroxy-4-methyl-2H-chromen-2-one, 4-Methyllimetol, and 4-Methyl-5,7-dihydroxycoumarin.

What is the IUPAC name of 5,7-Dihydroxy-4-methylcoumarin?

The IUPAC name of 5,7-Dihydroxy-4-methylcoumarin is 5,7-dihydroxy-4-methylchromen-2-one.

What is the InChIKey of 5,7-Dihydroxy-4-methylcoumarin?

The InChIKey of 5,7-Dihydroxy-4-methylcoumarin is QNVWGEJMXOQQPM-UHFFFAOYSA-N.

What is the canonical SMILES of 5,7-Dihydroxy-4-methylcoumarin?

The canonical SMILES of 5,7-Dihydroxy-4-methylcoumarin is CC1=CC(=O)OC2=CC(=CC(=C12)O)O.

What is the CAS number of 5,7-Dihydroxy-4-methylcoumarin?

The CAS number of 5,7-Dihydroxy-4-methylcoumarin is 2107-76-8.

What is the European Community (EC) number of 5,7-Dihydroxy-4-methylcoumarin?

The European Community (EC) number of 5,7-Dihydroxy-4-methylcoumarin is 218-289-9.

What is the XLogP3-AA value of 5,7-Dihydroxy-4-methylcoumarin?

The XLogP3-AA value of 5,7-Dihydroxy-4-methylcoumarin is 1.1.

What is the topological polar surface area of 5,7-Dihydroxy-4-methylcoumarin?

The topological polar surface area of 5,7-Dihydroxy-4-methylcoumarin is 66.8 ?2.

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