6286 1 2 3 4 5 6 7 8 9 10 11 12 11 8 8 8 6 6 6 1 1 1 1 1 1 1 3 -1 2 2 3 4 5 5 5 6 6 6 5 12 7 7 6 7 8 9 10 11 1 1 1 2 1 1 1 1 1 1 5 2 6 7 8 3 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 2 5.4641 2.866 3.732 4.5981 4.5981 3.732 4.5981 5.2181 4.5981 3.9781 6.001 -0.25 -0.25 0.25 -1.25 0.25 1.25 -0.25 -0.37 1.25 1.87 1.25 0.06 3 5 2 0 Compound Canonicalized 5 2008.01.11 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 53.5 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 3 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 1 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 0000037180403020000000000000000000000000000000000000000000000000000000000000001A00000800000814A080020208000002000800009008020000000000000000014000000110000000000000000000000100000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 sodium;2-hydroxypropanoate IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 sodium;2-hydroxypropanoate IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 sodium;2-hydroxypropanoate IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 sodium;2-hydroxypropanoate IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 sodium;2-oxidanylpropanoate IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 sodium;lactate InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/C3H6O3.Na/c1-2(4)3(5)6;/h2,4H,1H3,(H,5,6);/q;+1/p-1 InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 NGSFWBMYFKHRBD-UHFFFAOYSA-M Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 112.01363830 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C3H5NaO3 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 112.06 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 CC(C(=O)[O-])O.[Na+] SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 CC(C(=O)[O-])O.[Na+] Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 60.4 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 112.01363830 7 1 0 1 0 0 0 0 2 -1