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Methyl 2-(1-phenylethylimino)acetate

HCID 10104016
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
COC(=O)C=NC(C)c1ccccc1
InChIKey
UXRHYUSIOTYRRH-UHFFFAOYSA-N
Molecular formula
C11H13NO2
Average molar mass
191.23 g/mol

Names & identifiers

Preferred name
Methyl 2-(1-phenylethylimino)acetate
IUPAC
methyl 2-(1-phenylethylimino)acetate

Names & synonyms

SCHEMBL18993197SCHEMBL28226121

Database identifiers

PubChem CID
10104016
Nikkaji
J1.247.333H

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
38.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
14
Formal charge
0
Complexity
207

Related reactions

1 records
New reaction record
HRID 282203 reaction equation
HRID 282203As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

Compound notes

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