712 1 2 3 4 8 6 1 1 1 2 2 2 3 4 2 1 1 1 5 255 1 2 3 4 3.403 2.5369 2 2.5369 0.56 0.06 0.37 -0.56 0 Compound Canonicalized 5 2011.04.04 1 Compound Complexity 7 E_COMPLEXITY 3.384 Cactvs xemistry.com 2011.09.13 2 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.384 Cactvs xemistry.com 2011.09.13 1 Count Hydrogen Bond Donor 5 E_NHDONORS 3.384 Cactvs xemistry.com 2011.09.13 0 Count Rotatable Bond 5 E_NROTBONDS 3.384 Cactvs xemistry.com 2011.09.13 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.384 Cactvs xemistry.com 2011.09.13 00000371000020000000000000000000000000000000000000000000000000000000000000000012000000000000000000020000000000000800000080000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.0.2 LexiChem openeye.com 2011.09.13 formaldehyde IUPAC Name CAS-like Style 1 2.0.2 LexiChem openeye.com 2011.09.13 formaldehyde IUPAC Name Preferred 1 2.0.2 LexiChem openeye.com 2011.09.13 formaldehyde IUPAC Name Systematic 1 2.0.2 LexiChem openeye.com 2011.09.13 methanal IUPAC Name Traditional 1 2.0.2 LexiChem openeye.com 2011.09.13 formaldehyde InChI Standard 1 1.0.3 InChI nist.gov 2011.09.13 InChI=1S/CH2O/c1-2/h1H2 InChIKey Standard 1 1.0.3 InChI nist.gov 2011.09.13 WSFSSNUMVMOOMR-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2011.09.13 1.2 Mass Exact 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 30.010565 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 CH2O Molecular Weight 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 30.02598 SMILES Canonical 1 1.7.4 OEChem openeye.com 2011.09.13 C=O SMILES Isomeric 1 1.7.4 OEChem openeye.com 2011.09.13 C=O Topological Polar Surface Area 7 E_TPSA 3.384 Cactvs xemistry.com 2011.09.13 17.1 Weight MonoIsotopic 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 30.010565 2 0 0 0 0 0 0 0 1 1