1-Butynyl alpha-phenyl-alpha-(1-butynyloxy)phenylacetate

HCID 21521909
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Basic information

Standard SMILES
CCC#COC(=O)C(OC#CCC)(c1ccccc1)c1ccccc1
InChIKey
UXTDMLUYMZYAOB-UHFFFAOYSA-N
Molecular formula
C22H20O3
Average molar mass
332.4 g/mol

Names & identifiers

Preferred name
1-Butynyl alpha-phenyl-alpha-(1-butynyloxy)phenylacetate
IUPAC
but-1-ynyl 2-but-1-ynoxy-2,2-diphenylacetate

Names & synonyms

SCHEMBL11774882UXTDMLUYMZYAOB-UHFFFAOYSA-N1-butynyl alpha-phenyl-alpha-(1-butynyloxy)phenylacetate

Database identifiers

PubChem CID
21521909

Properties

Computed structural properties

XLogP
6.1
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
25

Related reactions

1 records
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Compound notes

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