Ethyl 7-(2,5-dimethoxy-3,4,6-trimethylphenyl)-2,2-dimethyl-7-phenylheptanoate

HCID 19088026
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Basic information

Standard SMILES
CCOC(=O)C(C)(C)CCCCC(c1ccccc1)c1c(C)c(OC)c(C)c(C)c1OC
InChIKey
HUTXBSQHBUSHOU-UHFFFAOYSA-N
Molecular formula
C28H40O4
Average molar mass
440.6 g/mol

Names & identifiers

Preferred name
Ethyl 7-(2,5-dimethoxy-3,4,6-trimethylphenyl)-2,2-dimethyl-7-phenylheptanoate
IUPAC
ethyl 7-(2,5-dimethoxy-3,4,6-trimethylphenyl)-2,2-dimethyl-7-phenylheptanoate

Names & synonyms

SCHEMBL9310950HUTXBSQHBUSHOU-UHFFFAOYSA-Nethyl 7-(2,5-dimethoxy-3,4,6-trimethylphenyl)-2,2-dimethyl-7-phenylheptanoate

Database identifiers

PubChem CID
19088026

Properties

Computed structural properties

XLogP
7.8
Topological polar surface area
44.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
12
Heavy atoms
32

Related reactions

7 records
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Linked notes

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