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1-Cyclopentylethanone

Catalog Number ACM6004600
CAS 6004-60-0
Structure 1-Cyclopentylethanone
IUPAC Name 1-cyclopentylethanone
Synonyms 1-CYCLOPENTYLETHANONE;6004-60-0;1-Cyclopentyl-ethanone;Cyclopentyl methyl ketone;Ethanone, 1-cyclopentyl-;Acetylcyclopentane;Cyclopentylethanone;Ketone, cyclopentyl methyl;1-cyclopentylethan-1-one;Ethanone, 1-cyclopentyl- (9CI);Methyl cyclopentyl ketone;UNII-N7CM8FC0UL;MFCD00060799;N7CM8FC0UL;Ethanone,1-cyclopentyl-;NSC 49209;PubChem16480;1-Cyclopentylethanone #;SCHEMBL498170;AMY7477;DTXSID20208768;Ketone, cyclopentyl methyl (8CI);1-cyclopentyl-ethanone, AldrichCPR;ACT04101;ALBB-012222;NSC49209;ZINC1681283;8951AB;ANW-58691;NSC-49209;AKOS002657092;ZINC100039601;AC-5229;CS-W020214;MCULE-7952211819;SB37877;AK-76937;AS-10630;SY035519;AB0082070;DB-005089;BB 0222347;C2074;FT-0600344;EN300-64634;W-6397;004C600;A832585;Z1575143881
Molecular Weight 112.17g/mol
Molecular Formula C7H12O
Canonical SMILES CC(=O)C1CCCC1
InChI InChI=1S/C7H12O/c1-6(8)7-4-2-3-5-7/h7H,2-5H2,1H3
InChI Key LKENTYLPIUIMFG-UHFFFAOYSA-N
Boiling Point 158.5 °C
Complexity 90.6
Covalently-Bonded Unit Count 1
Exact Mass 112.088815002g/mol
Heavy Atom Count 8
Hydrogen Bond Acceptor Count 1
Monoisotopic Mass 112.088815002g/mol
NSC Number 49209
Rotatable Bond Count 1
Topological Polar Surface Area 17.1Ų
UNII N7CM8FC0UL
X Log P3 1.5
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