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Ethyl 3-(2-hydroxyphenyl)-2-methylprop-2-enoate (HCID 54032398)|Huagongshe
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Compound
Ethyl 3-(2-hydroxyphenyl)-2-methylprop-2-enoate
HCID
54032398
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Compound notes
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Basic information
Standard SMILES
CCOC(=O)C(C)=Cc1ccccc1O
InChIKey
LGNCSKJFXGNLAY-UHFFFAOYSA-N
Molecular formula
C12H14O3
Average molar mass
206.24 g/mol
Monoisotopic mass
206.0942943
Names & identifiers
Preferred name
Ethyl 3-(2-hydroxyphenyl)-2-methylprop-2-enoate
IUPAC
ethyl 3-(2-hydroxyphenyl)-2-methylprop-2-enoate
Names & synonyms
SCHEMBL3123693
Database identifiers
PubChem CID
54032398
Properties
Computed structural properties
XLogP
2.6
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
15
Formal charge
0
Complexity
245
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Related reactions
1 records
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As solvent
HRID
197020
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Compound notes
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