1-Iodo-5-(2,5-dimethoxy-3,4,6-trimethylphenyl)-5-phenylpentane

HCID 19088084
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Basic information

Standard SMILES
COc1c(C)c(C)c(OC)c(C(CCCCI)c2ccccc2)c1C
InChIKey
XEBKQGQHHMSNNF-UHFFFAOYSA-N
Molecular formula
C22H29IO2
Average molar mass
452.4 g/mol

Names & identifiers

Preferred name
1-Iodo-5-(2,5-dimethoxy-3,4,6-trimethylphenyl)-5-phenylpentane
IUPAC
1-(5-iodo-1-phenylpentyl)-2,5-dimethoxy-3,4,6-trimethylbenzene

Names & synonyms

SCHEMBL9311108XEBKQGQHHMSNNF-UHFFFAOYSA-N1-iodo-5-(2,5-dimethoxy-3,4,6-trimethylphenyl)-5-phenylpentane

Database identifiers

PubChem CID
19088084

Properties

Computed structural properties

XLogP
7.6
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
8
Heavy atoms
25

Related reactions

4 records
New reaction record

Linked notes

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