potassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate

C6H12KO7Sb — CID 174945582

IUPACpotassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate
SMILESO=C(O[SbH2])C(O)C(O)C(=O)OCCO.[H-].[K+]
InChIInChI=1S/C6H10O7.K.Sb.3H/c7-1-2-13-6(12)4(9)3(8)5(10)11;;;;;/h3-4,7-9H,1-2H2,(H,10,11);;;;;/q;2*+1;;;-1/p-1
InChIKeyVSJFGMIVAMUZFT-UHFFFAOYSA-M
MW357.01 g/mol
LogP-6.55
Rot. Bonds5

About potassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate

potassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate (PubChem CID 174945582) has the molecular formula C6H12KO7Sb and a molecular weight of 357.01 g/mol. Its IUPAC name is potassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate.

Molecular Properties

Compound Namepotassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate
PubChem CID174945582
Molecular FormulaC6H12KO7Sb
Molecular Weight357.01 g/mol
Exact Mass355.93
IUPAC Namepotassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate
SMILESO=C(O[SbH2])C(O)C(O)C(=O)OCCO.[H-].[K+]
InChIInChI=1S/C6H10O7.K.Sb.3H/c7-1-2-13-6(12)4(9)3(8)5(10)11;;;;;/h3-4,7-9H,1-2H2,(H,10,11);;;;;/q;2*+1;;;-1/p-1
InChIKeyVSJFGMIVAMUZFT-UHFFFAOYSA-M
XLogP-6.55
TPSA113.29 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.01
LogP ≤ 5-6.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

bis[2-(2-hydroxyethoxy)ethyl] 2,3-dihydroxybutanedioate
CID 175191375
2-hydroxyethyl (2R)-2-hydroxypropanoate
CID 14273570
sodium;hydride;2-hydroxyethyl (2S)-2-aminopropanoate
CID 174523367
2,3-dihydroxy-4-(2-hydroxyethoxy)-4-oxobutanoic acid;ethoxyethane;bis(prop-1-ene)
CID 173084491
2-hydroxyethyl 2,4-dimethylpentanoate
CID 118601483
2-hydroxyethyl 2-(aminomethyl)-4-hydroxybutanoate
CID 87228341
2-hydroxyethyl (2S)-2-amino-3-hydroxypropanoate
CID 174781046
2,4-dihydroxybutaneperoxoic acid
CID 175057595
4-hydroxybutyl 2,3-dihydroxypropanoate
CID 141224989
bis[2-(dimethylamino)ethyl] 2,3-dihydroxybutanedioate
CID 174588921
1-O-[3-[(2R,3R)-4-[3-[(2R,3R)-2,3-dihydroxy-4-(3-methoxypropoxy)-4-oxobutanoyl]oxypropoxy]-2,3-dihydroxy-4-oxobutanoyl]oxypropyl] 4-O-(3-methoxypropyl) (2R,3R)-2,3-dihydroxybutanedioate
CID 101011423
2-(3-carboxy-2,3-dihydroxypropanoyl)oxyethyl-trimethylazanium;2-hydroxyethyl(trimethyl)azanium
CID 118341268

Frequently Asked Questions

What is the IUPAC name of potassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate?
The IUPAC name of potassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate (CID 174945582) is potassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate.
What is the SMILES notation for potassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate?
The canonical SMILES for potassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate is O=C(O[SbH2])C(O)C(O)C(=O)OCCO.[H-].[K+].
What is the InChIKey of potassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate?
The InChIKey is VSJFGMIVAMUZFT-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H10O7.K.Sb.3H/c7-1-2-13-6(12)4(9)3(8)5(10)11;;;;;/h3-4,7-9H,1-2H2,(H,10,11);;;;;/q;2*+1;;;-1/p-1.
What are the key properties of potassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate?
potassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate has a molecular weight of 357.01 g/mol, XLogP of -6.55, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;1-O-(2-hydroxyethyl) 4-O-stibanyl 2,3-dihydroxybutanedioate is sourced from PubChem (CID 174945582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).