dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate

C133H245O46S11+11 — CID 159235618

IUPACdibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate
SMILESCC(C)C(=O)OCCOC(=O)C[S+](C)C.CC(C)C(=O)OCCOC(=O)C[S+]1CCCC1.CC(C)C(=O)OCCOC(=O)C[S+]1CCCCC1.CC(C)C(=O)OCCOC(=O)C[S+]1CCOCC1.CCC(=O)OCCOC(=O)C[S+](C)C.CCC(=O)OCCOC(=O)C[S+](CC)CC.CCC(=O)OCCOC(=O)C[S+]1CCCCC1.CCC(=O)OCCOC(=O)C[S+]1CCOCC1.CCCC[S+](CCCC)CC(=O)OCCOC(=O)C(C)C.CCCC[S+](CCCC)CC(=O)OCCOC(=O)CC.CC[S+](CC)CC(=O)OCCOC(=O)C(C)C
InChIInChI=1S/C16H31O4S.C15H29O4S.C13H23O4S.C12H21O5S.2C12H21O4S.C12H23O4S.C11H19O5S.C11H21O4S.C10H19O4S.C9H17O4S/c1-5-7-11-21(12-8-6-2)13-15(17)19-9-10-20-16(18)14(3)4;1-4-7-11-20(12-8-5-2)13-15(17)19-10-9-18-14(16)6-3;1-11(2)13(15)17-7-6-16-12(14)10-18-8-4-3-5-9-18;1-10(2)12(14)17-4-3-16-11(13)9-18-7-5-15-6-8-18;1-10(2)12(14)16-6-5-15-11(13)9-17-7-3-4-8-17;1-2-11(13)15-6-7-16-12(14)10-17-8-4-3-5-9-17;1-5-17(6-2)9-11(13)15-7-8-16-12(14)10(3)4;1-2-10(12)15-3-4-16-11(13)9-17-7-5-14-6-8-17;1-4-10(12)14-7-8-15-11(13)9-16(5-2)6-3;1-8(2)10(12)14-6-5-13-9(11)7-15(3)4;1-4-8(10)12-5-6-13-9(11)7-14(2)3/h14H,5-13H2,1-4H3;4-13H2,1-3H3;11H,3-10H2,1-2H3;10H,3-9H2,1-2H3;10H,3-9H2,1-2H3;2-10H2,1H3;10H,5-9H2,1-4H3;2-9H2,1H3;4-9H2,1-3H3;8H,5-7H2,1-4H3;4-7H2,1-3H3/q11*+1
InChIKeyKTKXZYUESLEFLO-UHFFFAOYSA-N
MW2933.11 g/mol
LogP13.61
Rot. Bonds82

About dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate

dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate (PubChem CID 159235618) has the molecular formula C133H245O46S11+11 and a molecular weight of 2933.11 g/mol. Its IUPAC name is dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate.

Molecular Properties

Compound Namedibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate
PubChem CID159235618
Molecular FormulaC133H245O46S11+11
Molecular Weight2933.11 g/mol
Exact Mass2930.37
IUPAC Namedibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate
SMILESCC(C)C(=O)OCCOC(=O)C[S+](C)C.CC(C)C(=O)OCCOC(=O)C[S+]1CCCC1.CC(C)C(=O)OCCOC(=O)C[S+]1CCCCC1.CC(C)C(=O)OCCOC(=O)C[S+]1CCOCC1.CCC(=O)OCCOC(=O)C[S+](C)C.CCC(=O)OCCOC(=O)C[S+](CC)CC.CCC(=O)OCCOC(=O)C[S+]1CCCCC1.CCC(=O)OCCOC(=O)C[S+]1CCOCC1.CCCC[S+](CCCC)CC(=O)OCCOC(=O)C(C)C.CCCC[S+](CCCC)CC(=O)OCCOC(=O)CC.CC[S+](CC)CC(=O)OCCOC(=O)C(C)C
InChIInChI=1S/C16H31O4S.C15H29O4S.C13H23O4S.C12H21O5S.2C12H21O4S.C12H23O4S.C11H19O5S.C11H21O4S.C10H19O4S.C9H17O4S/c1-5-7-11-21(12-8-6-2)13-15(17)19-9-10-20-16(18)14(3)4;1-4-7-11-20(12-8-5-2)13-15(17)19-10-9-18-14(16)6-3;1-11(2)13(15)17-7-6-16-12(14)10-18-8-4-3-5-9-18;1-10(2)12(14)17-4-3-16-11(13)9-18-7-5-15-6-8-18;1-10(2)12(14)16-6-5-15-11(13)9-17-7-3-4-8-17;1-2-11(13)15-6-7-16-12(14)10-17-8-4-3-5-9-17;1-5-17(6-2)9-11(13)15-7-8-16-12(14)10(3)4;1-2-10(12)15-3-4-16-11(13)9-17-7-5-14-6-8-17;1-4-10(12)14-7-8-15-11(13)9-16(5-2)6-3;1-8(2)10(12)14-6-5-13-9(11)7-15(3)4;1-4-8(10)12-5-6-13-9(11)7-14(2)3/h14H,5-13H2,1-4H3;4-13H2,1-3H3;11H,3-10H2,1-2H3;10H,3-9H2,1-2H3;10H,3-9H2,1-2H3;2-10H2,1H3;10H,5-9H2,1-4H3;2-9H2,1H3;4-9H2,1-3H3;8H,5-7H2,1-4H3;4-7H2,1-3H3/q11*+1
InChIKeyKTKXZYUESLEFLO-UHFFFAOYSA-N
XLogP13.61
TPSA597.06 Ų
H-Bond Donors
H-Bond Acceptors46
Rotatable Bonds82
Heavy Atoms190
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002933.11
LogP ≤ 513.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1046

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}

Analyze dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate with MolForge

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Related Compounds

[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxymethyl 2-methylpropanoate
CID 58780042
dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium
CID 58780013
2-acetyloxyethyl 2-(1,4-oxathian-4-ium-4-yl)acetate
CID 58779988
2-(2-ethoxyethoxy)ethyl 2-(1,4-oxathian-4-ium-4-yl)acetate
CID 58779972
ethyl 2-(thian-1-ium-1-yl)acetate bromide
CID 10825824
dibutyl-[2-[2-(2,2-dimethylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium
CID 58780041
butyl 2-methylpropanoate;2-methylpropane
CID 157176975
dibutyl-[2-(3-methoxy-3-oxopropoxy)-2-oxoethyl]sulfanium
CID 58780009
2-[2-(2-acetyloxyethoxy)ethoxy]ethyl 2-(thiolan-1-ium-1-yl)acetate
CID 58780076
[2-(2-butanoyloxyethoxy)-2-oxoethyl]-diethylsulfanium
CID 58780124
pentyl propanoate;hydrofluoride
CID 174645674
2-aminoethyl 2-methylpropanoate;butyl 2-methylpropanoate
CID 159728832

Frequently Asked Questions

What is the IUPAC name of dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate?
The IUPAC name of dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate (CID 159235618) is dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate.
What is the SMILES notation for dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate?
The canonical SMILES for dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate is CC(C)C(=O)OCCOC(=O)C[S+](C)C.CC(C)C(=O)OCCOC(=O)C[S+]1CCCC1.CC(C)C(=O)OCCOC(=O)C[S+]1CCCCC1.CC(C)C(=O)OCCOC(=O)C[S+]1CCOCC1.CCC(=O)OCCOC(=O)C[S+](C)C.CCC(=O)OCCOC(=O)C[S+](CC)CC.CCC(=O)OCCOC(=O)C[S+]1CCCCC1.CCC(=O)OCCOC(=O)C[S+]1CCOCC1.CCCC[S+](CCCC)CC(=O)OCCOC(=O)C(C)C.CCCC[S+](CCCC)CC(=O)OCCOC(=O)CC.CC[S+](CC)CC(=O)OCCOC(=O)C(C)C.
What is the InChIKey of dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate?
The InChIKey is KTKXZYUESLEFLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31O4S.C15H29O4S.C13H23O4S.C12H21O5S.2C12H21O4S.C12H23O4S.C11H19O5S.C11H21O4S.C10H19O4S.C9H17O4S/c1-5-7-11-21(12-8-6-2)13-15(17)19-9-10-20-16(18)14(3)4;1-4-7-11-20(12-8-5-2)13-15(17)19-10-9-18-14(16)6-3;1-11(2)13(15)17-7-6-16-12(14)10-18-8-4-3-5-9-18;1-10(2)12(14)17-4-3-16-11(13)9-18-7-5-15-6-8-18;1-10(2)12(14)16-6-5-15-11(13)9-17-7-3-4-8-17;1-2-11(13)15-6-7-16-12(14)10-17-8-4-3-5-9-17;1-5-17(6-2)9-11(13)15-7-8-16-12(14)10(3)4;1-2-10(12)15-3-4-16-11(13)9-17-7-5-14-6-8-17;1-4-10(12)14-7-8-15-11(13)9-16(5-2)6-3;1-8(2)10(12)14-6-5-13-9(11)7-15(3)4;1-4-8(10)12-5-6-13-9(11)7-14(2)3/h14H,5-13H2,1-4H3;4-13H2,1-3H3;11H,3-10H2,1-2H3;10H,3-9H2,1-2H3;10H,3-9H2,1-2H3;2-10H2,1H3;10H,5-9H2,1-4H3;2-9H2,1H3;4-9H2,1-3H3;8H,5-7H2,1-4H3;4-7H2,1-3H3/q11*+1.
What are the key properties of dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate?
dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate has a molecular weight of 2933.11 g/mol, XLogP of 13.61, 82 rotatable bonds, 0 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dibutyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;diethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;diethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;dimethyl-[2-[2-(2-methylpropanoyloxy)ethoxy]-2-oxoethyl]sulfanium;dimethyl-[2-oxo-2-(2-propanoyloxyethoxy)ethyl]sulfanium;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(1,4-oxathian-4-ium-4-yl)acetyl]oxyethyl propanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate;2-[2-(thian-1-ium-1-yl)acetyl]oxyethyl propanoate;2-[2-(thiolan-1-ium-1-yl)acetyl]oxyethyl 2-methylpropanoate is sourced from PubChem (CID 159235618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).