(E)-methyl 2-[2-(6-bromopyrid-2-yloxymethyl)phenyl]-3-hydroxyacrylate

HCID 19366331
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Basic information

Standard SMILES
COC(=O)/C(=C/O)c1ccccc1COc1cccc(Br)n1
InChIKey
YAQPQAPEUXFNCA-UKTHLTGXSA-N
Molecular formula
C16H14BrNO4
Average molar mass
364.19 g/mol

Names & identifiers

Preferred name
(E)-methyl 2-[2-(6-bromopyrid-2-yloxymethyl)phenyl]-3-hydroxyacrylate
IUPAC
methyl (E)-2-[2-[(6-bromo-2-pyridinyl)oxymethyl]phenyl]-3-hydroxyprop-2-enoate

Names & synonyms

SCHEMBL7784787YAQPQAPEUXFNCA-UKTHLTGXSA-N(E)-methyl 2-[2-(6-bromopyrid-2-yloxymethyl)phenyl]-3-hydroxyacrylate

Database identifiers

PubChem CID
19366331

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
68.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
22

Related reactions

1 records
New reaction record

Linked notes

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