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3,9-Bis(acetyloxy)-6H-benzofuro[3,2-c][1]benzopyran-6-one

3,9-Bis(acetyloxy)-6H-benzofuro[3,2-c][1]benzopyran-6-one structure

CAS No:
35826-57-4
Formula:
C19H12O7
Chemical Name:
3,9-Bis(acetyloxy)-6H-benzofuro[3,2-c][1]benzopyran-6-one
Synonyms:
6H-Benzofuro[3,2-c][1]benzopyran-6-one,3,9-bis(acetyloxy)-;3-Benzofurancarboxylic acid,2-(2,4-dihydroxyphenyl)-6-hydroxy-,δ-lactone,diacetate;3,9-Bis(acetyloxy)-6H-benzofuro[3,2-c][1]benzopyran-6-one;Coumestrol diacetate;7,12-Diacetoxycoumestane;3,9-Diacetoxy-6H-benzofuro[3,2-c][1]benzopyran-6-one;NSC 70641

Description

ChEBI: A member of the class of coumestans that is the diacetate ester derivative of coumestrol.

Coumestrol diacetate is a member of the class of coumestans that is the diacetate ester derivative of coumestrol. It is a member of coumestans, a delta-lactone and an acetate ester. It derives from a coumestrol.

3,9-Bis(acetyloxy)-6H-benzofuro[3,2-c][1]benzopyran-6-one Basic Attributes

Molecular Weight：

352.297

Exact Mass：

352.29

UNII：

X24J95M1PC

NSC Number：

70641

Characteristics

PSA：

XLogP3：

Melting Point：

234-235 °C @ Solvent: Acetone, Ethanol

Water Solubility：

DMSO: soluble

Safety Information

wgk germany：

hazard class code：

36/37/38

safety instructions：

Marks：

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:352.3
XLogP3:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:352.05830272
Monoisotopic Mass:352.05830272
Topological Polar Surface Area:92
Heavy Atom Count:26
Complexity:603
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,9-Bis(acetyloxy)-6H-benzofuro[3,2-c][1]benzopyran-6-one

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties

3,9-Bis(acetyloxy)-6H-benzofuro[3,2-c][1]benzopyran-6-one

SDS

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