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 7 5 6 5 9 8 11 16 10 17 13 18 12 19 12 21 13 20 23 22 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 2.7029 6.3518 3.3424 5.7123 7.0547 2 6.7328 2.3219 4.9422 4.1125 2.5182 6.5365 3.5408 5.5139 1.394 7.6607 1.9088 7.1459 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 7 5 6 9 8 11 10 13 12 12 13 0 Compound Canonicalized 5 2011.04.04 1 Compound Complexity 7 E_COMPLEXITY 3.384 Cactvs xemistry.com 2011.04.04 165 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.384 Cactvs xemistry.com 2011.04.04 0 Count Hydrogen Bond Donor 5 E_NHDONORS 3.384 Cactvs xemistry.com 2011.04.04 0 Count Rotatable Bond 5 E_NROTBONDS 3.384 Cactvs xemistry.com 2011.04.04 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.384 Cactvs xemistry.com 2011.04.04 00000371C0700000000000000000000000000000000180000000306000000000000060014000001800000000000C008018003000800000008002204200000200002000000888000000880820228011108020002080000888070080C00E80000000001000000000000000200001000008000000 IUPAC Name Allowed 1 2.0.2 LexiChem openeye.com 2011.04.04 9H-fluorene IUPAC Name CAS-like Style 1 2.0.2 LexiChem openeye.com 2011.04.04 9H-fluorene IUPAC Name Preferred 1 2.0.2 LexiChem openeye.com 2011.04.04 9H-fluorene IUPAC Name Systematic 1 2.0.2 LexiChem openeye.com 2011.04.04 9H-fluorene IUPAC Name Traditional 1 2.0.2 LexiChem openeye.com 2011.04.04 fluorene InChI Standard 1 1.0.3 InChI nist.gov 2011.04.04 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 1.0.3 InChI nist.gov 2011.04.04 NIHNNTQXNPWCJQ-UHFFFAOYSA-N Log P XLogP3 7 3.0 sioc-ccbg.ac.cn 2011.04.04 4.2 Mass Exact 7 2.1 PubChem ncbi.nlm.nih.gov 2011.04.04 166.07825 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2011.04.04 C13H10 Molecular Weight 7 2.1 PubChem ncbi.nlm.nih.gov 2011.04.04 166.2185 SMILES Canonical 1 1.7.4 OEChem openeye.com 2011.04.04 C1C2=CC=CC=C2C3=CC=CC=C31 SMILES Isomeric 1 1.7.4 OEChem openeye.com 2011.04.04 C1C2=CC=CC=C2C3=CC=CC=C31 Topological Polar Surface Area 7 E_TPSA 3.384 Cactvs xemistry.com 2011.04.04 0 Weight MonoIsotopic 7 2.1 PubChem ncbi.nlm.nih.gov 2011.04.04 166.07825 13 0 0 0 0 0 0 0 1 1