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1-Cyclopentyl-2-phenylethan-1-one

HCID 10397602
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(Cc1ccccc1)C1CCCC1
InChIKey
HRTOGRYKCYADLD-UHFFFAOYSA-N
Molecular formula
C13H16O
Average molar mass
188.26 g/mol

Names & identifiers

Preferred name
1-Cyclopentyl-2-phenylethan-1-one
IUPAC
1-cyclopentyl-2-phenylethanone

Names & synonyms

1-cyclopentyl-2-phenylethan-1-one54321-44-71-cyclopentyl-2-phenylethanoneSCHEMBL800064HRTOGRYKCYADLD-UHFFFAOYSA-NDB-121354EN300-256122

Database identifiers

PubChem CID
10397602
Nikkaji
J595.514I

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
14
Formal charge
0
Complexity
185

Related reactions

6 records
New reaction record
HRID 401127 reaction equation
HRID 401127As reactantuspto-grants-2014_06
HRID 401217 reaction equation
HRID 401217As productuspto-grants-2014_06
HRID 924916 reaction equation
HRID 924916As reactantuspto-grants-2016_03
HRID 925007 reaction equation
HRID 925007As productuspto-grants-2016_03
HRID 2178011 reaction equation
HRID 2178011As reactantuspto-grants-2015_06
HRID 2178101 reaction equation
HRID 2178101As productuspto-grants-2015_06

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes