C8 H7 Cl O2
PHQ
benzyl chlorocarbonate
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
benzyl chlorocarbonate
Formula
Standard InChI
InChI=1S/C8H7ClO2/c9-8(10)11-6-7-4-2-1-3-5-7/h1-5H,6H2
Standard InChI Key
HSDAJNMJOMSNEV-UHFFFAOYSA-N
SMILES
c1ccc(cc1)COC(=O)Cl
Source OpenEye
Is part of
CLC_000431 CLC_000432 CLC_000438 CLC_000439 CLC_000440 CLC_000441 CLC_002429 P0H PHV PHW PRD_000272 PRD_000277 PRD_000295 PRD_000309 PRD_000330 PRD_000331 PRD_000332 PRD_000334 PRD_000335 PRD_000336 PRD_000337 PRD_000338 PRD_000339 PRD_000457 PRD_000670 PRD_000671 PRD_000672 PRD_000673 PRD_000674 PRD_000693 PRD_000694 PRD_000770 PRD_000911 PRD_000912 PRD_000935 PRD_000937 PRD_000960 PRD_001054 PRD_001061 PRD_001062 PRD_001076 PRD_001082 PRD_001095 PRD_001135 PRD_002087 PRD_002284 PRD_002352 RX3 T19 UB2 UB3 UBS UBT UBU UBV UBW UBX UBY UBZ VSC X32 XIB Y3A ZIL ZPR ZRA ZU3 ZU5.
First observed in
Overall view, and highlighted
scaffolds and fragments ![help icon]()
This image gallery displays several views of the ligand structure:
- Basic Structural Representation: Shows the overall structure of the ligand.
- Detailed Structural Representation: Highlights individual atoms within the ligand.
- Murcko Scaffold: Presents the scaffold of the ligand highlighted in yellow.
- Highlighted Fragments: Displays various ligand fragments, highlighted in yellow.
This image gallery displays several views of the ligand structure:
- Basic Structural Representation: Shows the overall structure of the ligand.
- Detailed Structural Representation: Highlights individual atoms within the ligand.
- Murcko Scaffold: Presents the scaffold of the ligand highlighted in yellow.
- Highlighted Fragments: Displays various ligand fragments, highlighted in yellow.
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