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(E)-(4R)-4,5-Isopropylidene-dioxy-1-(2-hydroxy-5-fluorophenyl)propenone

(E)-(4R)-4,5-Isopropylidene-dioxy-1-(2-hydroxy-5-fluorophenyl)propenone structure

CAS No:
797054-16-1
Formula:
C12H12FO4
Chemical Name:
(E)-(4R)-4,5-Isopropylidene-dioxy-1-(2-hydroxy-5-fluorophenyl)propenone
Synonyms:
SCHEMBL13766586;DTXSID50440078;ZINC38877431;(E)-3-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-1-(5-fluoro-2-hydroxyphenyl)prop-2-en-1-one

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Description

Yellow Solid

(E)-(4R)-4,5-Isopropylidene-dioxy-1-(2-hydroxy-5-fluorophenyl)propenone Basic Attributes

Molecular Weight：

239.2196832

Exact Mass：

266.095

DSSTox ID：

DTXSID50440078

Characteristics

PSA：

55.8

XLogP3：

2.4

(E)-(4R)-4,5-Isopropylidene-dioxy-1-(2-hydroxy-5-fluorophenyl)propenone Use and Manufacturing

(+)-Nebivolol intermediate.

Computed Properties

Molecular Weight:266.26
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:266.09543712
Monoisotopic Mass:266.09543712
Topological Polar Surface Area:55.8
Heavy Atom Count:19
Complexity:367
Defined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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(E)-(4R)-4,5-Isopropylidene-dioxy-1-(2-hydroxy-5-fluorophenyl)propenone

797054-17-2

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Guide of (E)-(4R)-4,5-Isopropylidene-dioxy-1-(2-hydroxy-5-fluorophenyl)propenone

Description
Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties
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(E)-(4R)-4,5-Isopropylidene-dioxy-1-(2-hydroxy-5-fluorophenyl)propenone

SDS

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