2-Chloro-1-(4,5-dihydro-5-phenyl-3-isoxazolyl)ethanone

HCID 86631246
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Basic information

Standard SMILES
O=C(CCl)C1=NOC(c2ccccc2)C1
InChIKey
FQVIRHYXHPBTFZ-UHFFFAOYSA-N
Molecular formula
C11H10ClNO2
Average molar mass
223.65 g/mol
Monoisotopic mass
223.0400063

Names & identifiers

Preferred name
2-Chloro-1-(4,5-dihydro-5-phenyl-3-isoxazolyl)ethanone
IUPAC
2-chloro-1-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)ethanone

Names & synonyms

2-chloro-1-(4,5-dihydro-5-phenyl-3-isoxazolyl)ethanoneSCHEMBL1979983FQVIRHYXHPBTFZ-UHFFFAOYSA-N

Database identifiers

PubChem CID
86631246

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
38.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
15

Related reactions

7 records
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Compound notes

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