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2-[(5S)-Dihydro-5-propyl-2(3H)-furanylidene]-1,3-cyclopentanedione

2-[(5S)-Dihydro-5-propyl-2(3H)-furanylidene]-1,3-cyclopentanedione structure

CAS No:
31323-50-9
Formula:
C12H16O3
Chemical Name:
2-[(5S)-Dihydro-5-propyl-2(3H)-furanylidene]-1,3-cyclopentanedione
Synonyms:
1,3-Cyclopentanedione,2-[(5S)-dihydro-5-propyl-2(3H)-furanylidene]-;1,3-Cyclopentanedione,2-(dihydro-5-propyl-2(3H)-furylidene)-,(S)-;1,3-Cyclopentanedione,2-(dihydro-5-propyl-2(3H)-furanylidene)-,(S)-;2-[(5S)-Dihydro-5-propyl-2(3H)-furanylidene]-1,3-cyclopentanedione;Oudenone;2-[(5S)-5-Propyloxolan-2-ylidene]cyclopentane-1,3-dione;11075-50-6;11075-51-7

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2-[(5S)-Dihydro-5-propyl-2(3H)-furanylidene]-1,3-cyclopentanedione Basic Attributes

Molecular Weight：

208.25

Exact Mass：

208.25

DSSTox ID：

DTXSID70185252

Characteristics

PSA：

43.4 Å²

Density：

1.1227

Melting Point：

77.5°C

Boiling Point：

255.5°C (estimate)

Refractive Index：

1.5350 (estimate)

Toxicity：

LD50 orl-mus: 1100 mg/kg 85ERAY 3,2018,78

Drug Information

MeSH Entry Terms：

(S)-2-(4,5-dihydro-5-propyl-2(3H)- furylidene)-1,3-cyclopentanedione

Computed Properties

Molecular Weight:208.25
XLogP3:1.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:208.109944368
Monoisotopic Mass:208.109944368
Topological Polar Surface Area:43.4
Heavy Atom Count:15
Complexity:310
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(5S)-Dihydro-5-propyl-2(3H)-furanylidene]-1,3-cyclopentanedione

Basic Attributes
Characteristics
Drug Information
Computed Properties

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