alpha-Bromo-3'-methoxy-4'-chloropropoxyacetophenone

HCID 22015629
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Basic information

Standard SMILES
COc1cc(C(=O)CBr)ccc1OCCCCl
InChIKey
JNJFZUQDPHCBST-UHFFFAOYSA-N
Molecular formula
C12H14BrClO3
Average molar mass
321.59 g/mol

Names & identifiers

Preferred name
alpha-Bromo-3'-methoxy-4'-chloropropoxyacetophenone
IUPAC
2-bromo-1-[4-(3-chloropropoxy)-3-methoxyphenyl]ethanone

Names & synonyms

SCHEMBL5262941JNJFZUQDPHCBST-UHFFFAOYSA-Nalpha-bromo-3'-methoxy-4'-chloropropoxyacetophenone

Database identifiers

PubChem CID
22015629

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
17

Related reactions

5 records
New reaction record

Linked notes

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