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1,3,8-Trihydroxy-6-methyl-9(10H)-anthracenone

1,3,8-Trihydroxy-6-methyl-9(10H)-anthracenone structure

CAS No:
491-60-1
Formula:
C15H12O4
Chemical Name:
1,3,8-Trihydroxy-6-methyl-9(10H)-anthracenone
Synonyms:
9(10H)-Anthracenone,1,3,8-trihydroxy-6-methyl-;Anthrone,1,3,8-trihydroxy-6-methyl-;1,3,8-Trihydroxy-6-methyl-9(10H)-anthracenone;Emodin anthrone;Emodin-9-anthrone;Frangula emodin anthrone;1314041-10-5
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

Description

Solid

Emodin anthrone is a member of the class of anthracenones that is anthracen-9(10H)-one which carries a methyl group at position 6 and hydroxy groups at positions 1, 3 and 8, respectively. It is an intermediate precursor in the synthesis of hypericin. It has a role as a fungal metabolite. It is an anthracenone and a member of phenols.

1,3,8-Trihydroxy-6-methyl-9(10H)-anthracenone Basic Attributes

Molecular Weight：

256.25

Exact Mass：

256.25

UNII：

77C500W1A2

DSSTox ID：

DTXSID80197684

Characteristics

PSA：

77.8

XLogP3：

2.24700

Appearance：

Solid

Density：

1.471 g/cm3

Melting Point：

254-258 °C (decomp)

Boiling Point：

556.2ºC at 760 mmHg

Refractive Index：

1.723

Drug Information

MeSH Entry Terms：

1,3,8-trihydroxy-6-methylanthrone

Computed Properties

Molecular Weight:256.25
XLogP3:3.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Exact Mass:256.07355886
Monoisotopic Mass:256.07355886
Topological Polar Surface Area:77.8
Heavy Atom Count:19
Complexity:369
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Emodin anthrone

CAS No.: 491-60-1

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Guide of 1,3,8-Trihydroxy-6-methyl-9(10H)-anthracenone

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties
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