(E)-methyl 2-[2-(6-chloropyrid-2-yloxymethyl)phenyl]-3-hydroxyacrylate
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Basic information
- Standard SMILES
COC(=O)/C(=C/O)c1ccccc1COc1cccc(Cl)n1- InChIKey
IZENAJGYDDKMTH-UKTHLTGXSA-N- Molecular formula
- C16H14ClNO4
- Average molar mass
- 319.74 g/mol
Names & identifiers
- Preferred name
- (E)-methyl 2-[2-(6-chloropyrid-2-yloxymethyl)phenyl]-3-hydroxyacrylate
- IUPAC
- methyl (E)-2-[2-[(6-chloro-2-pyridinyl)oxymethyl]phenyl]-3-hydroxyprop-2-enoate
Names & synonyms
SCHEMBL7778217IZENAJGYDDKMTH-UKTHLTGXSA-N(E)-methyl 2-[2-(6-chloropyrid-2-yloxymethyl)phenyl]-3-hydroxyacrylate
Database identifiers
- PubChem CID
- 19366332
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 68.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 402
Related reactions
2 records
Compound notes
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