(3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane

C173H354N8O79Si9 — CID 163473863

IUPAC(3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane
SMILESC.CCCCC(CC)COC(=O)C(CO)OC(=O)NCCC[Si](OC)(OC)OC.CCCCC(CC)COC(=O)C(O)COC(=O)CCCC[Si](OC)(OC)OC.CCCCN(C)C(=O)C(O)COC(=O)CCCC[Si](OC)(OC)OC.CCCCNC(=O)OC(CO)C(=O)N(C)CCCC.CCCCOC(=O)C(CO)OC(=O)N(CCCC)CCC[Si](OC)(OC)OC.CCCCOC(=O)C(CO)OC(=O)NCCC[Si](OC)(OC)OC.CCCCOC(=O)C(O)COC(=O)CCCC[Si](OC)(OC)OC.CCCCOC(=O)C(O)COC(=O)N(CCCC)CCC[Si](OC)(OC)OC.CCCCOCC(C)OCC(C)OC(=O)C(CO)OC(=O)NCCC[Si](OC)(OC)OC.CCCCOCC(C)OCC(C)OC(=O)C(O)COC(=O)CCCC[Si](OC)(OC)OC
InChIInChI=1S/C21H42O10Si.C20H41NO10Si.C19H38O8Si.3C18H37NO8Si.C16H33NO7Si.C15H30O8Si.C14H29NO8Si.C13H26N2O4.CH4/c1-7-8-12-28-14-17(2)29-15-18(3)31-21(24)19(22)16-30-20(23)11-9-10-13-32(25-4,26-5)27-6;1-7-8-11-28-14-16(2)29-15-17(3)30-19(23)18(13-22)31-20(24)21-10-9-12-32(25-4,26-5)27-6;1-6-8-11-16(7-2)14-27-19(22)17(20)15-26-18(21)12-9-10-13-28(23-3,24-4)25-5;1-6-8-10-15(7-2)14-26-17(21)16(13-20)27-18(22)19-11-9-12-28(23-3,24-4)25-5;1-6-8-11-19(12-10-14-28(23-3,24-4)25-5)18(22)27-15-16(20)17(21)26-13-9-7-2;1-6-8-11-19(12-10-14-28(23-3,24-4)25-5)18(22)27-16(15-20)17(21)26-13-9-7-2;1-6-7-11-17(2)16(20)14(18)13-24-15(19)10-8-9-12-25(21-3,22-4)23-5;1-5-6-10-22-15(18)13(16)12-23-14(17)9-7-8-11-24(19-2,20-3)21-4;1-5-6-9-22-13(17)12(11-16)23-14(18)15-8-7-10-24(19-2,20-3)21-4;1-4-6-8-14-13(18)19-11(10-16)12(17)15(3)9-7-5-2;/h17-19,22H,7-16H2,1-6H3;16-18,22H,7-15H2,1-6H3,(H,21,24);16-17,20H,6-15H2,1-5H3;15-16,20H,6-14H2,1-5H3,(H,19,22);2*16,20H,6-15H2,1-5H3;14,18H,6-13H2,1-5H3;13,16H,5-12H2,1-4H3;12,16H,5-11H2,1-4H3,(H,15,18);11,16H,4-10H2,1-3H3,(H,14,18);1H4
InChIKeyBYUHELVHOSQUOQ-UHFFFAOYSA-N
MW4063.49 g/mol
LogP17.72
Rot. Bonds154

About (3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane

(3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane (PubChem CID 163473863) has the molecular formula C173H354N8O79Si9 and a molecular weight of 4063.49 g/mol. Its IUPAC name is (3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane.

Molecular Properties

Compound Name(3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane
PubChem CID163473863
Molecular FormulaC173H354N8O79Si9
Molecular Weight4063.49 g/mol
Exact Mass4060.19
IUPAC Name(3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane
SMILESC.CCCCC(CC)COC(=O)C(CO)OC(=O)NCCC[Si](OC)(OC)OC.CCCCC(CC)COC(=O)C(O)COC(=O)CCCC[Si](OC)(OC)OC.CCCCN(C)C(=O)C(O)COC(=O)CCCC[Si](OC)(OC)OC.CCCCNC(=O)OC(CO)C(=O)N(C)CCCC.CCCCOC(=O)C(CO)OC(=O)N(CCCC)CCC[Si](OC)(OC)OC.CCCCOC(=O)C(CO)OC(=O)NCCC[Si](OC)(OC)OC.CCCCOC(=O)C(O)COC(=O)CCCC[Si](OC)(OC)OC.CCCCOC(=O)C(O)COC(=O)N(CCCC)CCC[Si](OC)(OC)OC.CCCCOCC(C)OCC(C)OC(=O)C(CO)OC(=O)NCCC[Si](OC)(OC)OC.CCCCOCC(C)OCC(C)OC(=O)C(O)COC(=O)CCCC[Si](OC)(OC)OC
InChIInChI=1S/C21H42O10Si.C20H41NO10Si.C19H38O8Si.3C18H37NO8Si.C16H33NO7Si.C15H30O8Si.C14H29NO8Si.C13H26N2O4.CH4/c1-7-8-12-28-14-17(2)29-15-18(3)31-21(24)19(22)16-30-20(23)11-9-10-13-32(25-4,26-5)27-6;1-7-8-11-28-14-16(2)29-15-17(3)30-19(23)18(13-22)31-20(24)21-10-9-12-32(25-4,26-5)27-6;1-6-8-11-16(7-2)14-27-19(22)17(20)15-26-18(21)12-9-10-13-28(23-3,24-4)25-5;1-6-8-10-15(7-2)14-26-17(21)16(13-20)27-18(22)19-11-9-12-28(23-3,24-4)25-5;1-6-8-11-19(12-10-14-28(23-3,24-4)25-5)18(22)27-15-16(20)17(21)26-13-9-7-2;1-6-8-11-19(12-10-14-28(23-3,24-4)25-5)18(22)27-16(15-20)17(21)26-13-9-7-2;1-6-7-11-17(2)16(20)14(18)13-24-15(19)10-8-9-12-25(21-3,22-4)23-5;1-5-6-10-22-15(18)13(16)12-23-14(17)9-7-8-11-24(19-2,20-3)21-4;1-5-6-9-22-13(17)12(11-16)23-14(18)15-8-7-10-24(19-2,20-3)21-4;1-4-6-8-14-13(18)19-11(10-16)12(17)15(3)9-7-5-2;/h17-19,22H,7-16H2,1-6H3;16-18,22H,7-15H2,1-6H3,(H,21,24);16-17,20H,6-15H2,1-5H3;15-16,20H,6-14H2,1-5H3,(H,19,22);2*16,20H,6-15H2,1-5H3;14,18H,6-13H2,1-5H3;13,16H,5-12H2,1-4H3;12,16H,5-11H2,1-4H3,(H,15,18);11,16H,4-10H2,1-3H3,(H,14,18);1H4
InChIKeyBYUHELVHOSQUOQ-UHFFFAOYSA-N
XLogP17.72
TPSA1057.05 Ų
H-Bond Donors14
H-Bond Acceptors79
Rotatable Bonds154
Heavy Atoms269
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004063.49
LogP ≤ 517.72
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1079

Computed Properties (RDKit)

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

Analyze (3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane with MolForge

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Launch Full Analysis

Related Compounds

[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate
CID 163473866
2-[1-[1-(2-ethylhexoxy)propan-2-yloxy]propan-2-yloxycarbonylamino]ethyl 2,2-dimethylbutanoate
CID 121473987
1-O-[2-(2-butoxyethoxy)ethyl] 6-O-(2-ethylhexyl) hexanedioate
CID 141478579
2-ethylhexyl 16-[16-(2-ethylhexoxy)-16-oxohexadecoxy]hexadecanoate
CID 91184211
2-ethylhexyl 4-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]butanoate
CID 121469950
O-[1-(1-butoxypropan-2-yloxy)-3-sulfanylpropan-2-yl] N-butyl-N-(3-trimethoxysilylpropyl)carbamothioate
CID 162502894
7-O-(2-ethylhexyl) 1-O-(2-methylpropyl) heptanedioate
CID 91718206
bis(2-ethylhexyl) nonanedioate
CID 7642
bis[(2R)-2-ethylhexyl] nonanedioate
CID 25113357
2-ethylhexyl 2-[2-ethylhexoxycarbonyl(methyl)amino]-3-methylbutanoate
CID 91737930
decyl 2-[2-ethylhexoxycarbonyl(methyl)amino]-3-methylbutanoate
CID 91737921
hexadecyl 2-[2-ethylhexoxycarbonyl(methyl)amino]-3-methylbutanoate
CID 91737927

Frequently Asked Questions

What is the IUPAC name of (3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane?
The IUPAC name of (3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane (CID 163473863) is (3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane.
What is the SMILES notation for (3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane?
The canonical SMILES for (3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane is C.CCCCC(CC)COC(=O)C(CO)OC(=O)NCCC[Si](OC)(OC)OC.CCCCC(CC)COC(=O)C(O)COC(=O)CCCC[Si](OC)(OC)OC.CCCCN(C)C(=O)C(O)COC(=O)CCCC[Si](OC)(OC)OC.CCCCNC(=O)OC(CO)C(=O)N(C)CCCC.CCCCOC(=O)C(CO)OC(=O)N(CCCC)CCC[Si](OC)(OC)OC.CCCCOC(=O)C(CO)OC(=O)NCCC[Si](OC)(OC)OC.CCCCOC(=O)C(O)COC(=O)CCCC[Si](OC)(OC)OC.CCCCOC(=O)C(O)COC(=O)N(CCCC)CCC[Si](OC)(OC)OC.CCCCOCC(C)OCC(C)OC(=O)C(CO)OC(=O)NCCC[Si](OC)(OC)OC.CCCCOCC(C)OCC(C)OC(=O)C(O)COC(=O)CCCC[Si](OC)(OC)OC.
What is the InChIKey of (3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane?
The InChIKey is BYUHELVHOSQUOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H42O10Si.C20H41NO10Si.C19H38O8Si.3C18H37NO8Si.C16H33NO7Si.C15H30O8Si.C14H29NO8Si.C13H26N2O4.CH4/c1-7-8-12-28-14-17(2)29-15-18(3)31-21(24)19(22)16-30-20(23)11-9-10-13-32(25-4,26-5)27-6;1-7-8-11-28-14-16(2)29-15-17(3)30-19(23)18(13-22)31-20(24)21-10-9-12-32(25-4,26-5)27-6;1-6-8-11-16(7-2)14-27-19(22)17(20)15-26-18(21)12-9-10-13-28(23-3,24-4)25-5;1-6-8-10-15(7-2)14-26-17(21)16(13-20)27-18(22)19-11-9-12-28(23-3,24-4)25-5;1-6-8-11-19(12-10-14-28(23-3,24-4)25-5)18(22)27-15-16(20)17(21)26-13-9-7-2;1-6-8-11-19(12-10-14-28(23-3,24-4)25-5)18(22)27-16(15-20)17(21)26-13-9-7-2;1-6-7-11-17(2)16(20)14(18)13-24-15(19)10-8-9-12-25(21-3,22-4)23-5;1-5-6-10-22-15(18)13(16)12-23-14(17)9-7-8-11-24(19-2,20-3)21-4;1-5-6-9-22-13(17)12(11-16)23-14(18)15-8-7-10-24(19-2,20-3)21-4;1-4-6-8-14-13(18)19-11(10-16)12(17)15(3)9-7-5-2;/h17-19,22H,7-16H2,1-6H3;16-18,22H,7-15H2,1-6H3,(H,21,24);16-17,20H,6-15H2,1-5H3;15-16,20H,6-14H2,1-5H3,(H,19,22);2*16,20H,6-15H2,1-5H3;14,18H,6-13H2,1-5H3;13,16H,5-12H2,1-4H3;12,16H,5-11H2,1-4H3,(H,15,18);11,16H,4-10H2,1-3H3,(H,14,18);1H4.
What are the key properties of (3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane?
(3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane has a molecular weight of 4063.49 g/mol, XLogP of 17.72, 154 rotatable bonds, 14 hydrogen bond donors, and 79 hydrogen bond acceptors.
Where does this data come from?
All data for (3-butoxy-2-hydroxy-3-oxopropyl) 5-trimethoxysilylpentanoate;1-(1-butoxypropan-2-yloxy)propan-2-yl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[3-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;butyl 2-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-3-hydroxypropanoate;butyl 3-[butyl(3-trimethoxysilylpropyl)carbamoyl]oxy-2-hydroxypropanoate;butyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;[1-[butyl(methyl)amino]-3-hydroxy-1-oxopropan-2-yl] N-butylcarbamate;[3-[butyl(methyl)amino]-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;[3-(2-ethylhexoxy)-2-hydroxy-3-oxopropyl] 5-trimethoxysilylpentanoate;2-ethylhexyl 3-hydroxy-2-(3-trimethoxysilylpropylcarbamoyloxy)propanoate;methane is sourced from PubChem (CID 163473863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).