3-(4-Chlorobut-1-yl)-3-azabicyclo[3.1.0]hexane-2,4-dione

HCID 23289986
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Basic information

Standard SMILES
O=C1C2CC2C(=O)N1CCCCCl
InChIKey
SDHHLPLRQZJIRP-UHFFFAOYSA-N
Molecular formula
C9H12ClNO2
Average molar mass
201.65 g/mol
Monoisotopic mass
201.0556563

Names & identifiers

Preferred name
3-(4-Chlorobut-1-yl)-3-azabicyclo[3.1.0]hexane-2,4-dione
IUPAC
3-(4-chlorobutyl)-3-azabicyclo[3.1.0]hexane-2,4-dione

Names & synonyms

SCHEMBL7485374SDHHLPLRQZJIRP-UHFFFAOYSA-NAKOS0141663113-(4-chlorobut-1-yl)-3-azabicyclo[3.1.0]hexane-2,4-dione

Database identifiers

PubChem CID
23289986

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
37.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
13

Related reactions

2 records
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Compound notes

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