bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate

C163H218F11O19S5+5 — CID 157412530

IUPACbis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate
SMILESCC(C)(C)C(C(=O)c1ccc(Oc2ccccc2)cc1)[S+]1CCOCC1.CC(F)(F)C(=O)OCC12CC3CC(CC(C3)C1)C2.CC(F)(F)C(=O)OCC12CC3CC(CC(C3)C1)C2.CC(F)(F)C(F)COC(=O)C12CC3CC(CC(C3)C1)C2.CC(F)(F)COC(=O)C12CC3CC(CC(C3)C1)C2.CC(F)(F)COC(=O)C12CC3CC(CC(C3)C1)C2.CCCOc1ccc([S+]2CCOCC2)c2ccccc12.COc1ccc([S+]2CCCC2)c2ccccc12.Cc1ccc(C(=O)C([S+]2CCOCC2)C(C)(C)C)cc1.c1ccc2c([S+]3CCCC3)ccc(OCC3CCCCC3)c2c1
InChIInChI=1S/C22H27O3S.C21H27OS.C17H21O2S.C17H25O2S.C15H21F3O2.C15H17OS.4C14H20F2O2/c1-22(2,3)21(26-15-13-24-14-16-26)20(23)17-9-11-19(12-10-17)25-18-7-5-4-6-8-18;1-2-8-17(9-3-1)16-22-20-12-13-21(23-14-6-7-15-23)19-11-5-4-10-18(19)20;1-2-9-19-16-7-8-17(20-12-10-18-11-13-20)15-6-4-3-5-14(15)16;1-13-5-7-14(8-6-13)15(18)16(17(2,3)4)20-11-9-19-10-12-20;1-14(17,18)12(16)8-20-13(19)15-5-9-2-10(6-15)4-11(3-9)7-15;1-16-14-8-9-15(17-10-4-5-11-17)13-7-3-2-6-12(13)14;2*1-13(15,16)12(17)18-8-14-5-9-2-10(6-14)4-11(3-9)7-14;2*1-13(15,16)8-18-12(17)14-5-9-2-10(6-14)4-11(3-9)7-14/h4-12,21H,13-16H2,1-3H3;4-5,10-13,17H,1-3,6-9,14-16H2;3-8H,2,9-13H2,1H3;5-8,16H,9-12H2,1-4H3;9-12H,2-8H2,1H3;2-3,6-9H,4-5,10-11H2,1H3;4*9-11H,2-8H2,1H3/q4*+1;;+1;;;;
InChIKeyBOLKUVLZZSKUNT-UHFFFAOYSA-N
MW2850.83 g/mol
LogP38.14
Rot. Bonds34

About bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate

bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate (PubChem CID 157412530) has the molecular formula C163H218F11O19S5+5 and a molecular weight of 2850.83 g/mol. Its IUPAC name is bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate.

Molecular Properties

Compound Namebis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate
PubChem CID157412530
Molecular FormulaC163H218F11O19S5+5
Molecular Weight2850.83 g/mol
Exact Mass2848.45
IUPAC Namebis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate
SMILESCC(C)(C)C(C(=O)c1ccc(Oc2ccccc2)cc1)[S+]1CCOCC1.CC(F)(F)C(=O)OCC12CC3CC(CC(C3)C1)C2.CC(F)(F)C(=O)OCC12CC3CC(CC(C3)C1)C2.CC(F)(F)C(F)COC(=O)C12CC3CC(CC(C3)C1)C2.CC(F)(F)COC(=O)C12CC3CC(CC(C3)C1)C2.CC(F)(F)COC(=O)C12CC3CC(CC(C3)C1)C2.CCCOc1ccc([S+]2CCOCC2)c2ccccc12.COc1ccc([S+]2CCCC2)c2ccccc12.Cc1ccc(C(=O)C([S+]2CCOCC2)C(C)(C)C)cc1.c1ccc2c([S+]3CCCC3)ccc(OCC3CCCCC3)c2c1
InChIInChI=1S/C22H27O3S.C21H27OS.C17H21O2S.C17H25O2S.C15H21F3O2.C15H17OS.4C14H20F2O2/c1-22(2,3)21(26-15-13-24-14-16-26)20(23)17-9-11-19(12-10-17)25-18-7-5-4-6-8-18;1-2-8-17(9-3-1)16-22-20-12-13-21(23-14-6-7-15-23)19-11-5-4-10-18(19)20;1-2-9-19-16-7-8-17(20-12-10-18-11-13-20)15-6-4-3-5-14(15)16;1-13-5-7-14(8-6-13)15(18)16(17(2,3)4)20-11-9-19-10-12-20;1-14(17,18)12(16)8-20-13(19)15-5-9-2-10(6-15)4-11(3-9)7-15;1-16-14-8-9-15(17-10-4-5-11-17)13-7-3-2-6-12(13)14;2*1-13(15,16)12(17)18-8-14-5-9-2-10(6-14)4-11(3-9)7-14;2*1-13(15,16)8-18-12(17)14-5-9-2-10(6-14)4-11(3-9)7-14/h4-12,21H,13-16H2,1-3H3;4-5,10-13,17H,1-3,6-9,14-16H2;3-8H,2,9-13H2,1H3;5-8,16H,9-12H2,1-4H3;9-12H,2-8H2,1H3;2-3,6-9H,4-5,10-11H2,1H3;4*9-11H,2-8H2,1H3/q4*+1;;+1;;;;
InChIKeyBOLKUVLZZSKUNT-UHFFFAOYSA-N
XLogP38.14
TPSA230.25 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds34
Heavy Atoms198
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002850.83
LogP ≤ 538.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

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

Analyze bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate with MolForge

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Related Compounds

[4-[3-[4-[8-[Dihydroxy-oxo-(oxolan-3-ylmethyl)-lambda6-sulfanyl]-6-[2-(oxolan-3-yl)ethyl]naphthalen-2-yl]oxy-3-[2-(oxolan-3-yl)ethyl]benzoyl]-4-[4-(4-fluorobenzoyl)phenyl]phenyl]phenyl]-(4-fluorophenyl)methanone
CID 58769571
[1-(4-Butoxynaphthalen-1-yl)thiolan-1-yl] 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonate;[1-(2-naphthalen-2-yl-2-oxoethyl)thiolan-1-yl] trifluoromethanesulfonate
CID 139973418
CID 157102018
CID 157102018
3,3-difluorobutan-2-yl adamantane-1-carboxylate;bis(3,3-difluorobutan-2-yl 4-oxoadamantane-1-carboxylate);methane;tris(1-[4-(2-methoxyethoxy)naphthalen-1-yl]thiolan-1-ium);1,1,1,3,3-pentafluorobutan-2-yl 4-[(5S,8R,10S,13R,14S,17R)-10,13-dimethyl-3,7,12-trioxo-1,2,4,5,6,8,9,11,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoate
CID 157189193
4-(4-Butoxy-3,5-dimethylphenyl)-1,4-oxathian-4-ium;4-(4-butoxynaphthalen-1-yl)-1,4-oxathian-4-ium;4-(4-tert-butylphenyl)-1,4-oxathian-4-ium;4-[4-(cyclohexylmethoxy)naphthalen-1-yl]-1,4-oxathian-4-ium;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-phenylbutan-1-one;4-[4-(2-methoxyethoxy)naphthalen-1-yl]-1,4-oxathian-4-ium;1-naphthalen-2-yl-2-(1,4-oxathian-4-ium-4-yl)ethanone;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;4-[4-(2,2,2-trifluoroethoxy)naphthalen-1-yl]-1,4-oxathian-4-ium
CID 157260055
Tris(3,3-difluorobutan-2-yl adamantane-1-carboxylate);1-[4-(2-methoxyethoxy)naphthalen-1-yl]thiolan-1-ium;4-(thiolan-1-ium-1-yl)naphthalen-1-ol;triphenylsulfanium
CID 157331016
Tris(2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate);2-(1-adamantylmethoxy)-1,1-difluoro-2-oxoethanesulfonate;bis(1-adamantylmethylsulfamoyl(difluoro)methanesulfonate);1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;tris(1-(4-butoxyphenyl)-3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)butan-1-one);1-(4-methoxyphenyl)-3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;triphenylsulfanium
CID 157374135
CID 157447152
CID 157447152
Tris(1-adamantylmethyl 2,2-difluoropropanoate);4-(4-tert-butylphenyl)-1,4-oxathian-4-ium;1-(1,1-difluoroethylsulfonylmethyl)adamantane;2,2-difluoropropyl adamantane-1-carboxylate;ethane;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;1-(4-methoxyphenyl)-3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;bis(triphenylsulfanium)
CID 157517656
3-[4-Bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,1,2-tetrafluoropropane-2-sulfonate;3-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,1,2-tetrafluoropropane-2-sulfonate;3-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1,1-trifluoro-2-methylpropane-2-sulfonate;3-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1,1-trifluoro-2-methylpropane-2-sulfonate;1,1,1,2-tetrafluoro-3-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-2-sulfonate
CID 157569534
2,2-difluoropropyl adamantane-1-carboxylate;2,2-difluoropropyl 4-[(5S,8R,10S,13R,14S,17R)-10,13-dimethyl-3,7,12-trioxo-1,2,4,5,6,8,9,11,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoate;2,2-difluoropropyl 4-oxoadamantane-1-carboxylate;methane;tetrakis(1-[4-(2-methoxyethoxy)naphthalen-1-yl]thiolan-1-ium)
CID 157592671
2-[4-(4-Diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;6-(4-diphenylsulfoniophenoxy)-1,1,2,2,3,3-hexafluorohexane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate
CID 157628802

Frequently Asked Questions

What is the IUPAC name of bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate?
The IUPAC name of bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate (CID 157412530) is bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate.
What is the SMILES notation for bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate?
The canonical SMILES for bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate is CC(C)(C)C(C(=O)c1ccc(Oc2ccccc2)cc1)[S+]1CCOCC1.CC(F)(F)C(=O)OCC12CC3CC(CC(C3)C1)C2.CC(F)(F)C(=O)OCC12CC3CC(CC(C3)C1)C2.CC(F)(F)C(F)COC(=O)C12CC3CC(CC(C3)C1)C2.CC(F)(F)COC(=O)C12CC3CC(CC(C3)C1)C2.CC(F)(F)COC(=O)C12CC3CC(CC(C3)C1)C2.CCCOc1ccc([S+]2CCOCC2)c2ccccc12.COc1ccc([S+]2CCCC2)c2ccccc12.Cc1ccc(C(=O)C([S+]2CCOCC2)C(C)(C)C)cc1.c1ccc2c([S+]3CCCC3)ccc(OCC3CCCCC3)c2c1.
What is the InChIKey of bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate?
The InChIKey is BOLKUVLZZSKUNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27O3S.C21H27OS.C17H21O2S.C17H25O2S.C15H21F3O2.C15H17OS.4C14H20F2O2/c1-22(2,3)21(26-15-13-24-14-16-26)20(23)17-9-11-19(12-10-17)25-18-7-5-4-6-8-18;1-2-8-17(9-3-1)16-22-20-12-13-21(23-14-6-7-15-23)19-11-5-4-10-18(19)20;1-2-9-19-16-7-8-17(20-12-10-18-11-13-20)15-6-4-3-5-14(15)16;1-13-5-7-14(8-6-13)15(18)16(17(2,3)4)20-11-9-19-10-12-20;1-14(17,18)12(16)8-20-13(19)15-5-9-2-10(6-15)4-11(3-9)7-15;1-16-14-8-9-15(17-10-4-5-11-17)13-7-3-2-6-12(13)14;2*1-13(15,16)12(17)18-8-14-5-9-2-10(6-14)4-11(3-9)7-14;2*1-13(15,16)8-18-12(17)14-5-9-2-10(6-14)4-11(3-9)7-14/h4-12,21H,13-16H2,1-3H3;4-5,10-13,17H,1-3,6-9,14-16H2;3-8H,2,9-13H2,1H3;5-8,16H,9-12H2,1-4H3;9-12H,2-8H2,1H3;2-3,6-9H,4-5,10-11H2,1H3;4*9-11H,2-8H2,1H3/q4*+1;;+1;;;;.
What are the key properties of bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate?
bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate has a molecular weight of 2850.83 g/mol, XLogP of 38.14, 34 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-adamantylmethyl 2,2-difluoropropanoate);1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;bis(2,2-difluoropropyl adamantane-1-carboxylate);3,3-dimethyl-1-(4-methylphenyl)-2-(1,4-oxathian-4-ium-4-yl)butan-1-one;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-(4-phenoxyphenyl)butan-1-one;1-(4-methoxynaphthalen-1-yl)thiolan-1-ium;4-(4-propoxynaphthalen-1-yl)-1,4-oxathian-4-ium;2,3,3-trifluorobutyl adamantane-1-carboxylate is sourced from PubChem (CID 157412530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).