[2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate

C182H264Cl4N8O50 — CID 158225841

IUPAC[2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate
SMILESCCCCCC[C@@H](O)CCCCCCCCCCC(=O)O.CCCCCC[C@H](CCCCCCCCCCC(=O)O)OC(=O)CCl.CCCCCC[C@H](CCCCCCCCCCC(=O)O)OC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1.CCCCCC[C@H](CCCCCCCCCCC(=O)OCC(=O)Oc1ccc(N)cc1)OC(=O)COC(=O)c1ccc(N)cc1.CCCCCC[C@H](CCCCCCCCCCC(=O)OCC(=O)Oc1ccc(N=C=O)cc1)OC(=O)COC(=O)c1ccc(OC#N)cc1.CCCCCC[C@H](CCCCCCCCCCC(=O)OCC(=O)Oc1ccc([N+](=O)[O-])cc1)OC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1.O=C(CCl)Oc1ccc([N+](=O)[O-])cc1.O=C(Cl)CCl
InChIInChI=1S/C37H46N2O10.C35H46N2O12.C35H50N2O8.C27H41NO8.C20H37ClO4.C18H36O3.C8H6ClNO4.C2H2Cl2O/c1-2-3-4-11-14-32(48-36(43)26-46-37(44)29-17-21-31(22-18-29)47-27-38)15-12-9-7-5-6-8-10-13-16-34(41)45-25-35(42)49-33-23-19-30(20-24-33)39-28-40;1-2-3-4-11-14-30(48-34(40)26-47-35(41)27-17-19-28(20-18-27)36(42)43)15-12-9-7-5-6-8-10-13-16-32(38)46-25-33(39)49-31-23-21-29(22-24-31)37(44)45;1-2-3-4-11-14-30(44-34(40)26-43-35(41)27-17-19-28(36)20-18-27)15-12-9-7-5-6-8-10-13-16-32(38)42-25-33(39)45-31-23-21-29(37)22-24-31;1-2-3-4-11-14-24(15-12-9-7-5-6-8-10-13-16-25(29)30)36-26(31)21-35-27(32)22-17-19-23(20-18-22)28(33)34;1-2-3-4-11-14-18(25-20(24)17-21)15-12-9-7-5-6-8-10-13-16-19(22)23;1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21;9-5-8(11)14-7-3-1-6(2-4-7)10(12)13;3-1-2(4)5/h17-24,32H,2-16,25-26H2,1H3;17-24,30H,2-16,25-26H2,1H3;17-24,30H,2-16,25-26,36-37H2,1H3;17-20,24H,2-16,21H2,1H3,(H,29,30);18H,2-17H2,1H3,(H,22,23);17,19H,2-16H2,1H3,(H,20,21);1-4H,5H2;1H2/t32-;2*30-;24-;18-;17-;;/m111111../s1
InChIKeyGDUDIPWMCCKDSW-PWWYDIJVSA-N
MW3505.93 g/mol
LogP42.88
Rot. Bonds132

About [2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate

[2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate (PubChem CID 158225841) has the molecular formula C182H264Cl4N8O50 and a molecular weight of 3505.93 g/mol. Its IUPAC name is [2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate.

Molecular Properties

Compound Name[2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate
PubChem CID158225841
Molecular FormulaC182H264Cl4N8O50
Molecular Weight3505.93 g/mol
Exact Mass3501.71
IUPAC Name[2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate
SMILESCCCCCC[C@@H](O)CCCCCCCCCCC(=O)O.CCCCCC[C@H](CCCCCCCCCCC(=O)O)OC(=O)CCl.CCCCCC[C@H](CCCCCCCCCCC(=O)O)OC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1.CCCCCC[C@H](CCCCCCCCCCC(=O)OCC(=O)Oc1ccc(N)cc1)OC(=O)COC(=O)c1ccc(N)cc1.CCCCCC[C@H](CCCCCCCCCCC(=O)OCC(=O)Oc1ccc(N=C=O)cc1)OC(=O)COC(=O)c1ccc(OC#N)cc1.CCCCCC[C@H](CCCCCCCCCCC(=O)OCC(=O)Oc1ccc([N+](=O)[O-])cc1)OC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1.O=C(CCl)Oc1ccc([N+](=O)[O-])cc1.O=C(Cl)CCl
InChIInChI=1S/C37H46N2O10.C35H46N2O12.C35H50N2O8.C27H41NO8.C20H37ClO4.C18H36O3.C8H6ClNO4.C2H2Cl2O/c1-2-3-4-11-14-32(48-36(43)26-46-37(44)29-17-21-31(22-18-29)47-27-38)15-12-9-7-5-6-8-10-13-16-34(41)45-25-35(42)49-33-23-19-30(20-24-33)39-28-40;1-2-3-4-11-14-30(48-34(40)26-47-35(41)27-17-19-28(20-18-27)36(42)43)15-12-9-7-5-6-8-10-13-16-32(38)46-25-33(39)49-31-23-21-29(22-24-31)37(44)45;1-2-3-4-11-14-30(44-34(40)26-43-35(41)27-17-19-28(36)20-18-27)15-12-9-7-5-6-8-10-13-16-32(38)42-25-33(39)45-31-23-21-29(37)22-24-31;1-2-3-4-11-14-24(15-12-9-7-5-6-8-10-13-16-25(29)30)36-26(31)21-35-27(32)22-17-19-23(20-18-22)28(33)34;1-2-3-4-11-14-18(25-20(24)17-21)15-12-9-7-5-6-8-10-13-16-19(22)23;1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21;9-5-8(11)14-7-3-1-6(2-4-7)10(12)13;3-1-2(4)5/h17-24,32H,2-16,25-26H2,1H3;17-24,30H,2-16,25-26H2,1H3;17-24,30H,2-16,25-26,36-37H2,1H3;17-20,24H,2-16,21H2,1H3,(H,29,30);18H,2-17H2,1H3,(H,22,23);17,19H,2-16H2,1H3,(H,20,21);1-4H,5H2;1H2/t32-;2*30-;24-;18-;17-;;/m111111../s1
InChIKeyGDUDIPWMCCKDSW-PWWYDIJVSA-N
XLogP42.88
TPSA857.05 Ų
H-Bond Donors6
H-Bond Acceptors51
Rotatable Bonds132
Heavy Atoms244
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003505.93
LogP ≤ 542.88
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1051

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze [2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate with MolForge

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Related Compounds

[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate
CID 118371431
(12R)-12-(4-nitrobenzoyl)oxyoctadecanoic acid;4-nitrophenol;[(7R)-18-(4-nitrophenoxy)-18-oxooctadecan-7-yl] 4-nitrobenzoate
CID 161022988
2-(4-isocyanatophenyl)ethyl (12R)-12-[3-(4-cyanatophenyl)-2-oxopropoxy]octadecanoate
CID 118371365
2-butyloctyl 10-(4-nitrophenoxy)carbonyloxyicosanoate
CID 156752967
2-butyloctyl 10-(4-nitrophenoxy)carbonyloxyhexadecanoate
CID 155368708
(4-nitrophenyl) hexacosanoate
CID 10907416
butyl 4-(4-nitrophenoxy)carbonyloxydodecanoate
CID 164737802
henicosan-11-yl (4-nitrophenyl) carbonate
CID 177314956
(4-nitrophenyl) tetratriacontan-17-yl carbonate
CID 58391317
hexadecanoic acid;(4-nitrophenyl) hydrogen carbonate
CID 68584643
[9-heptadecan-9-yloxy-2-[(4-nitrophenoxy)carbonyloxymethyl]-9-oxononyl] (9Z,12Z)-octadeca-9,12-dienoate
CID 172607810
2-butyloctyl 5-(4-nitrophenoxy)carbonyloxydodecanoate
CID 164938717

Frequently Asked Questions

What is the IUPAC name of [2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate?
The IUPAC name of [2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate (CID 158225841) is [2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate.
What is the SMILES notation for [2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate?
The canonical SMILES for [2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate is CCCCCC[C@@H](O)CCCCCCCCCCC(=O)O.CCCCCC[C@H](CCCCCCCCCCC(=O)O)OC(=O)CCl.CCCCCC[C@H](CCCCCCCCCCC(=O)O)OC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1.CCCCCC[C@H](CCCCCCCCCCC(=O)OCC(=O)Oc1ccc(N)cc1)OC(=O)COC(=O)c1ccc(N)cc1.CCCCCC[C@H](CCCCCCCCCCC(=O)OCC(=O)Oc1ccc(N=C=O)cc1)OC(=O)COC(=O)c1ccc(OC#N)cc1.CCCCCC[C@H](CCCCCCCCCCC(=O)OCC(=O)Oc1ccc([N+](=O)[O-])cc1)OC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1.O=C(CCl)Oc1ccc([N+](=O)[O-])cc1.O=C(Cl)CCl.
What is the InChIKey of [2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate?
The InChIKey is GDUDIPWMCCKDSW-PWWYDIJVSA-N. The full InChI is InChI=1S/C37H46N2O10.C35H46N2O12.C35H50N2O8.C27H41NO8.C20H37ClO4.C18H36O3.C8H6ClNO4.C2H2Cl2O/c1-2-3-4-11-14-32(48-36(43)26-46-37(44)29-17-21-31(22-18-29)47-27-38)15-12-9-7-5-6-8-10-13-16-34(41)45-25-35(42)49-33-23-19-30(20-24-33)39-28-40;1-2-3-4-11-14-30(48-34(40)26-47-35(41)27-17-19-28(20-18-27)36(42)43)15-12-9-7-5-6-8-10-13-16-32(38)46-25-33(39)49-31-23-21-29(22-24-31)37(44)45;1-2-3-4-11-14-30(44-34(40)26-43-35(41)27-17-19-28(36)20-18-27)15-12-9-7-5-6-8-10-13-16-32(38)42-25-33(39)45-31-23-21-29(37)22-24-31;1-2-3-4-11-14-24(15-12-9-7-5-6-8-10-13-16-25(29)30)36-26(31)21-35-27(32)22-17-19-23(20-18-22)28(33)34;1-2-3-4-11-14-18(25-20(24)17-21)15-12-9-7-5-6-8-10-13-16-19(22)23;1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21;9-5-8(11)14-7-3-1-6(2-4-7)10(12)13;3-1-2(4)5/h17-24,32H,2-16,25-26H2,1H3;17-24,30H,2-16,25-26H2,1H3;17-24,30H,2-16,25-26,36-37H2,1H3;17-20,24H,2-16,21H2,1H3,(H,29,30);18H,2-17H2,1H3,(H,22,23);17,19H,2-16H2,1H3,(H,20,21);1-4H,5H2;1H2/t32-;2*30-;24-;18-;17-;;/m111111../s1.
What are the key properties of [2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate?
[2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate has a molecular weight of 3505.93 g/mol, XLogP of 42.88, 132 rotatable bonds, 6 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(7R)-18-[2-(4-aminophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-aminobenzoate;2-chloroacetyl chloride;(12R)-12-(2-chloroacetyl)oxyoctadecanoic acid;(12R)-12-hydroxyoctadecanoic acid;[2-[(7R)-18-[2-(4-isocyanatophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-cyanatobenzoate;(12R)-12-[2-(4-nitrobenzoyl)oxyacetyl]oxyoctadecanoic acid;[2-[(7R)-18-[2-(4-nitrophenoxy)-2-oxoethoxy]-18-oxooctadecan-7-yl]oxy-2-oxoethyl] 4-nitrobenzoate;(4-nitrophenyl) 2-chloroacetate is sourced from PubChem (CID 158225841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).