12305030 1 2 3 4 5 6 7 8 9 10 8 8 8 8 8 6 6 6 6 6 1 2 3 4 5 6 6 7 8 9 6 7 8 9 10 7 8 9 10 10 2 2 2 2 2 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 2 3.7601 2.6723 5.5202 4.8479 2.9511 3.7601 3.2601 4.5691 4.2601 0.3952 1.6739 -1.6739 0.3952 -1.6739 0.0861 0.6739 -0.8649 0.0861 -0.8649 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 195 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 5 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0000037100603800000000000000000000000000000180000000000000000000000000000000000A000000000008040080000000000000000800801000000000000000000000010000000000120800000000000000000000000902000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 cyclopentane-1,2,3,4,5-pentone IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 cyclopentane-1,2,3,4,5-pentone IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 cyclopentane-1,2,3,4,5-pentone IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 cyclopentane-1,2,3,4,5-pentone IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 cyclopentane-1,2,3,4,5-pentone IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 cyclopentane-1,2,3,4,5-pentone InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C5O5/c6-1-2(7)4(9)5(10)3(1)8 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 YVVXMBHAKNKELS-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 -0.6 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 139.97457310 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C5O5 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 140.05 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1(=O)C(=O)C(=O)C(=O)C1=O SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1(=O)C(=O)C(=O)C(=O)C1=O Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 85.4 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 139.97457310 10 0 0 0 0 0 0 0 1 -1