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Hymecromone

CAT: 1299-RM-H251300-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-H251300-01Size:10 mg
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CAS Number
90-33-5
Synonyms
7-hydroxy-4-methyl-2H-chromen-2-one
Molecular Formula
C10H8O3
Molecular Weight
176.17
Target Alternative Name
Hymecromone
Product Name Synonym
7-hydroxy-4-methyl-2H-chromen-2-one

Chemical Information

4-Methylumbelliferone

4-methylumbelliferone is a hydroxycoumarin that is umbelliferone substituted by a methyl group at position 4. It has a role as a hyaluronic acid synthesis inhibitor and an antineoplastic agent. It is functionally related to an umbelliferone.

CAS Number90-33-5
PubChem CID5280567
IUPAC Name7-hydroxy-4-methylchromen-2-one
Molecular FormulaC10H8O3
Molecular Weight176.17
XLogP1.9
Topological Polar Surface Area46.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count13
Formal Charge0
Complexity257
SMILES
CC1=CC(=O)OC2=C1C=CC(=C2)O
InChI
InChI=1S/C10H8O3/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5,11H,1H3
InChIKey
HSHNITRMYYLLCV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Methylumbelliferone
CAS: 90-33-5
CID: 5280567
Formula: C10H8O3
MW: 176.17
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight176.17
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass176.047344113
Monoisotopic Mass176.047344113
Topological Polar Surface Area46.5 Ų
Heavy Atom Count13
Formal Charge0
Complexity257
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
AR-H07779-01Hymecromone
AR-H07775-01Hymecromone-13C4
AR-H07778-01Hymecromone Phosphate
AR-H07780-01Hymecromone-alfa-L-Iduronide
AR-H07781-01Hymecromone-beta-D-Glucuronide
AR-H07776-01Hymecromone-beta-D-Glucuronide-13C4
AR-H07777-016,8-Difluoro-Hymecromone Phosphate

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