1-Chloro-1-(2-oxocyclopentylidene)propan-2-yl acetate

HCID 71014140
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Basic information

CAS
1414642-69-5
Standard SMILES
CC(=O)OC(C)C(Cl)=C1CCCC1=O
InChIKey
ASMKZJUOJSUTOR-UHFFFAOYSA-N
Molecular formula
C10H13ClO3
Average molar mass
216.66 g/mol
Monoisotopic mass
216.05532196

Names & identifiers

Preferred name
1-Chloro-1-(2-oxocyclopentylidene)propan-2-yl acetate
IUPAC
[1-chloro-1-(2-oxocyclopentylidene)propan-2-yl] acetate

Names & synonyms

1-chloro-1-(2-oxocyclopentylidene)propan-2-yl acetateSCHEMBL13858011ASMKZJUOJSUTOR-UHFFFAOYSA-NDTXSID1012235972-[2-(Acetyloxy)-1-chloropropylidene]cyclopentanone1414642-69-5

Database identifiers

CAS
1414642-69-5
PubChem CID
71014140
DTXSID
DTXSID101223597

Properties

Computed structural propertiesFilling in

XLogP
1.3
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
14

Related reactions

3 records
New reaction record

Compound notes

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