59203684 1 2 3 4 5 6 7 8 9 10 11 12 13 8 8 7 6 6 1 1 1 1 1 1 1 1 3 1 1 1 2 2 3 3 3 4 4 4 5 5 3 4 5 13 10 11 12 5 6 7 8 9 1 1 1 1 1 1 1 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 5.135 2.5369 6.001 4.269 3.403 3.8705 4.6675 3.8015 3.0044 6.538 6.311 5.691 2 0.5 -0 0 0 0.5 -0.4749 -0.4749 0.9749 0.9749 -0.31 0.5369 -0.5369 0.31 1 Compound Canonicalized 5 2012.05.21 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 17.1 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 2 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 2 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 2 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371C0423000000000000000000000000000000000000000000000000000000000000000001A00140800000000A080020000000002000000000000000000000000000000000000000110000000000000000000000100000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 2-hydroxyethoxyammonium IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 2-hydroxyethoxyammonium IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 2-hydroxyethoxyazanium IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 2-hydroxyethoxyazanium IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 2-hydroxyethyloxyazanium IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 2-hydroxyethoxyammonium InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/C2H8NO2/c3-5-2-1-4/h4H,1-2H2,3H3/q+1 InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 NLRKAHJXGJHNHO-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2019.06.18 -1.4 Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 78.055503498 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C2H8NO2+ Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 78.09 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 C(CO[NH3+])O SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 C(CO[NH3+])O Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 57.1 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 78.055503498 5 0 0 0 0 0 0 0 1 -1