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1-(2,3-Dihydro-1,4-benzodioxin-5-yl)ethanone

HCID 21268052
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(=O)c1cccc2c1OCCO2
InChIKey
QMXNXMGUQSFTHC-UHFFFAOYSA-N
Molecular formula
C10H10O3
Average molar mass
178.18 g/mol

Names & identifiers

Preferred name
1-(2,3-Dihydro-1,4-benzodioxin-5-yl)ethanone
IUPAC
1-(2,3-dihydro-1,4-benzodioxin-5-yl)ethanone

Names & synonyms

19813-62-81-(2,3-dihydro-1,4-benzodioxin-5-yl)ethanone1-(2,3-Dihydro-1,4-benzodioxin-5-yl)-ethanone1-(2,3-dihydro-1,4-benzodioxin-5-yl)ethan-1-one1-(2,3-Dihydrobenzo[b][1,4]dioxin-5-yl)ethanone5-acetylbenzodioxaneSCHEMBL637323QMXNXMGUQSFTHC-UHFFFAOYSA-NMFCD18073164AKOS017516435DA-43352H59447
Show more names
(2,3-dihydro-benzo[1,4]dioxin-5-yl)-ethanone(2,3-dihydro-benzo[1.4]dioxin-5-yl)-ethanoneEN300-1854081

Database identifiers

PubChem CID
21268052

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
202

Related reactions

10 records
New reaction record
HRID 343849 reaction equation
HRID 343849As reactantuspto-grants-1999_01
HRID 515521 reaction equation
HRID 515521As productuspto-grants-2015_08
HRID 617790 reaction equation
HRID 617790As reactantuspto-grants-1999_09
HRID 619292 reaction equation
HRID 619292As reactantuspto-grants-1999_09
HRID 633683 reaction equation
HRID 633683As productuspto-grants-2016_04
HRID 732717 reaction equation
HRID 732717As reactantuspto-grants-2009_09
HRID 1182909 reaction equation
HRID 1182909As productuspto-grants-2014_03
HRID 1642322 reaction equation
HRID 1642322As productuspto-grants-2012_02
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Compound notes

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