1-(3-Bromo-2-methyloxyphenyl)heptane-1-one

HCID 59544892
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Basic information

Standard SMILES
CCCCCCC(=O)c1cccc(Br)c1OC
InChIKey
GTZLGDPBUGIFNG-UHFFFAOYSA-N
Molecular formula
C14H19BrO2
Average molar mass
299.2 g/mol

Names & identifiers

Preferred name
1-(3-Bromo-2-methyloxyphenyl)heptane-1-one
IUPAC
1-(3-bromo-2-methoxyphenyl)heptan-1-one

Names & synonyms

1-(3-Bromo-2-methyloxyphenyl)heptane-1-oneSCHEMBL3062231GTZLGDPBUGIFNG-UHFFFAOYSA-N952103-47-8DB-215525

Database identifiers

PubChem CID
59544892

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
7
Heavy atoms
17

Related reactions

3 records
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Compound notes

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