(E)-4-bromo-3-(6-methyl-pyridin-3-yloxy)-but-2-enoic acid ethyl ester

HCID 66895263
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Basic information

Standard SMILES
CCOC(=O)/C=C(\CBr)Oc1ccc(C)nc1
InChIKey
UHVHDAISEOIURI-IZZDOVSWSA-N
Molecular formula
C12H14BrNO3
Average molar mass
300.15 g/mol

Names & identifiers

Preferred name
(E)-4-bromo-3-(6-methyl-pyridin-3-yloxy)-but-2-enoic acid ethyl ester
IUPAC
ethyl (E)-4-bromo-3-[(6-methyl-3-pyridinyl)oxy]but-2-enoate

Names & synonyms

SCHEMBL1068507UHVHDAISEOIURI-IZZDOVSWSA-NDB-189847(E)-ethyl 3-(6-methylpyridin-3-yloxy)-4-bromobut-2-enoate(E)-4-bromo-3-(6-methyl-pyridin-3-yloxy)-but-2-enoic acid ethyl ester1192000-60-4

Database identifiers

PubChem CID
66895263

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
48.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
17

Related reactions

2 records
New reaction record

Compound notes

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