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Methoxymethyl 2-[bis(4-methoxymethoxyphenyl)methyl]benzoate

HCID 19938166
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Basic information

Standard SMILES
COCOC(=O)c1ccccc1C(c1ccc(OCOC)cc1)c1ccc(OCOC)cc1
InChIKey
DDEGMDCJVCLZOZ-UHFFFAOYSA-N
Molecular formula
C26H28O7
Average molar mass
452.5 g/mol

Names & identifiers

Preferred name
Methoxymethyl 2-[bis(4-methoxymethoxyphenyl)methyl]benzoate
IUPAC
methoxymethyl 2-[bis[4-(methoxymethoxy)phenyl]methyl]benzoate

Names & synonyms

SCHEMBL9121903DDEGMDCJVCLZOZ-UHFFFAOYSA-Nmethoxymethyl 2-[bis(4-methoxymethoxyphenyl)methyl]benzoatemethoxymethyl 2-[bis(4-methoxymethoxyphenyl)methyl]-benzoate

Database identifiers

PubChem CID
19938166

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
72.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
13
Heavy atoms
33
Formal charge
0
Complexity
513

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Related reactions

3 records
New reaction record
HRID 36450 reaction equation
HRID 36450As reactantuspto-grants-1995_05
HRID 150678 reaction equation
HRID 150678As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1196168 reaction equation
HRID 1196168As reactantuspto-grants-1992_05

Compound notes

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