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1-(2,5-Dihydropyrrol-1-yl)propan-1-one

HCID 178768036
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Basic information

CAS
178483-02-8
Standard SMILES
CCC(=O)N1CC=CC1
InChIKey
ROZBIAVNXJZNHW-UHFFFAOYSA-N
Molecular formula
C7H11NO
Average molar mass
125.17 g/mol

Names & identifiers

Preferred name
1-(2,5-Dihydropyrrol-1-yl)propan-1-one
IUPAC
1-(2,5-dihydropyrrol-1-yl)propan-1-one
English name
1H-Pyrrole,2,5-dihydro-1-(1-oxopropyl)-(9CI)
Molecular formula
C7H11NO
Molecular weight
125.17

Names & synonyms

178483-02-81-(2,5-dihydropyrrol-1-yl)propan-1-one1H-Pyrrole,2,5-dihydro-1-(1-oxopropyl)-(9CI)SCHEMBL9979892SCHEMBL16050618DB-2681081H-Pyrrole, 2,5-dihydro-1-(1-oxopropyl)-1-Propanone, 1-(2,5-dihydro-1H-pyrrol-1-yl)-

Database identifiers

CAS
178483-02-8

Properties

Computed structural propertiesFilling in

XLogP
0.4
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
9
Formal charge
0
Complexity
132

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