HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

3-(4-Formylbenzyl)hydantoin

HCID 18758564
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=Cc1ccc(CN2C(=O)CNC2=O)cc1
InChIKey
PMLMWTWOCBIDEI-UHFFFAOYSA-N
Molecular formula
C11H10N2O3
Average molar mass
218.21 g/mol
Monoisotopic mass
218.06914219

Names & identifiers

Preferred name
3-(4-Formylbenzyl)hydantoin
IUPAC
4-[(2,5-dioxoimidazolidin-1-yl)methyl]benzaldehyde

Names & synonyms

3-(4-formylbenzyl)hydantoinSCHEMBL378362PMLMWTWOCBIDEI-UHFFFAOYSA-N4-(2,5-dioxo-imidazolidin-1-ylmethyl)-benzaldehyde

Database identifiers

PubChem CID
18758564

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
66.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
Formal charge
0
Complexity
308

Related reactions

4 records
New reaction record
HRID 433222 reaction equation
HRID 433222As productuspto-grants-2003_12
HRID 591754 reaction equation
HRID 591754As productuspto-grants-2016_01
HRID 591755 reaction equation
HRID 591755As reactantuspto-grants-2016_01
HRID 1563644 reaction equation
HRID 1563644As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes