Dibenzyl 2-{4-[(di-tert-butoxyphosphoryl)methyl]benzyl}malonate

HCID 21265737
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Basic information

Standard SMILES
CC(C)(C)OP(=O)(Cc1ccc(CC(C(=O)OCc2ccccc2)C(=O)OCc2ccccc2)cc1)OC(C)(C)C
InChIKey
WGKVPDSTRUNPIF-UHFFFAOYSA-N
Molecular formula
C33H41O7P
Average molar mass
580.6 g/mol

Names & identifiers

Preferred name
Dibenzyl 2-{4-[(di-tert-butoxyphosphoryl)methyl]benzyl}malonate
IUPAC
dibenzyl 2-[[4-[bis[(2-methylpropan-2-yl)oxy]phosphorylmethyl]phenyl]methyl]propanedioate

Names & synonyms

WGKVPDSTRUNPIF-UHFFFAOYSA-NDibenzyl 2-{4-[(di-tert-butoxyphosphoryl)methyl]benzyl}malonate

Database identifiers

PubChem CID
21265737

Properties

Computed structural properties

XLogP
6.1
Topological polar surface area
88.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
16
Heavy atoms
41

Related reactions

1 records
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Compound notes

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