6853 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 3 3 4 4 5 6 6 7 7 8 8 9 9 10 10 11 11 12 13 2 3 14 15 4 6 5 7 5 8 9 10 16 11 17 12 18 13 19 12 20 13 21 22 23 1 1 1 1 1 2 1 2 1 2 2 1 1 1 1 1 1 1 1 2 1 2 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 4.5274 5.3364 3.7183 5.0274 4.0274 6.3518 2.7029 5.7123 3.3424 7.0547 2 6.7328 2.3219 4.9422 4.1125 6.5365 2.5182 5.5139 3.5408 7.6607 1.394 7.1459 1.9088 1.1618 0.574 0.574 -0.3771 -0.3771 0.8063 0.8063 -1.1618 -1.1618 0.0376 0.0376 -0.9531 -0.9531 1.6225 1.6225 1.3981 1.3981 -1.7492 -1.7492 0.1688 0.1688 -1.4154 -1.4154 8 8 8 8 8 8 8 8 8 8 8 8 2 2 3 3 4 5 6 7 8 9 10 11 4 6 5 7 8 9 10 11 12 13 12 13 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 165 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 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 00000371C0700000000000000000000000000000000180000000306000000000000060014000001800000000000C008018003000800000008002204200000200002000000888000000880820228011108020002080000888070080C00E80000000001000000000000000200001000008000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 9H-fluorene IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 9H-fluorene IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 9<I>H</I>-fluorene IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 9H-fluorene IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 9H-fluorene IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 fluorene InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C13H10/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-8H,9H2 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 NIHNNTQXNPWCJQ-UHFFFAOYSA-N Log P XLogP3 7 3.0 sioc-ccbg.ac.cn 2021.10.14 4.2 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 166.078250319 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C13H10 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 166.22 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1C2=CC=CC=C2C3=CC=CC=C31 SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1C2=CC=CC=C2C3=CC=CC=C31 Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 166.078250319 13 0 0 0 0 0 0 0 1 -1