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Methylumbelliferone

Methylumbelliferone structure

CAS No:
531-59-9
Formula:
C10H8O3
Chemical Name:
Methylumbelliferone
Synonyms:
2H-1-Benzopyran-2-one,7-methoxy-;Herniarin;Coumarin,7-methoxy-;Umbelliferone,methyl ether;7-Methoxy-2H-1-benzopyran-2-one;Ayapanin;7-Methoxycoumarin;Methylumbelliferone;NSC 404559;7-Methoxychromen-2-one;Gerniarin;7-Methoxy-2H-chromen-2-one
Categories:
Biochemical Engineering > Plant Extracts

Description

Herniarin is a natural coumarin occurs in some flowering plants, with antitumor effect.

Solid

Herniarin is a member of the class of coumarins that is coumarin substituted by a methoxy group at position 7. It has a role as a fluorochrome.

Methylumbelliferone Basic Attributes

Molecular Weight：

176.17

Exact Mass：

176.17

BRN：

141728

EC Number：

208-513-3

UNII：

DGK72G008A

NSC Number：

404559

DSSTox ID：

DTXSID5060196

HScode：

2932209090

Characteristics

PSA：

35.5

XLogP3：

1.9

Appearance：

Beige to salmon-pinkish Powder

Density：

1.2±0.1 g/cm3

Melting Point：

117-118 °C

Boiling Point：

130 °C @ Press: 0.02 Torr

Flash Point：

138.6±21.1 °C

Refractive Index：

1.572

Water Solubility：

Micible with water.DMF: soluble

Storage Conditions：

Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Safety Information

Hazard category：

IRRITANT

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

22-24/25-36-26

RTECS Number：

DJ3100380

Marks：

Stability/Shelf Life：

Stable at room temperature in closed containers under normal storage and handling conditions.

Drug Information

Metabolism/Metabolites：

7-methoxycoumarin has known human metabolites that include 4-Hydroxy-7-methoxycoumarin and 7-Hydroxycoumarin.

MeSH Entry Terms：

7-methoxycoumarin

Methylumbelliferone Use and Manufacturing

Manufacturing Info：

2H-1-Benzopyran-2-one, 7-methoxy-: ACTIVE

Computed Properties

Molecular Weight:176.17
XLogP3:1.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:176.047344113
Monoisotopic Mass:176.047344113
Topological Polar Surface Area:35.5
Heavy Atom Count:13
Complexity:234
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Butyl acrylate

Potassium carbonate

Acetone

Dimethyl sulfate

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Guide of Methylumbelliferone

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Material
Recommended Suppliers
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