1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene

C189H256O42 — CID 165013617

IUPAC1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene
SMILESC=CCc1cc(C(C)(C)c2ccc(OCC(O)COc3c(COC)cc(-c4cc(COC)c(OC)c(COC)c4)cc3COC)c(CC=C)c2)ccc1OCC(O)CC.CCC(O)COC.CCC(O)COCCCCOCC(O)COc1c(COC)cc(-c2cc(COC)c(OC)c(COC)c2)cc1COC.CCC(O)COc1c(C)cc(-c2cc(C)c(OCC(O)COc3c(COC)cc(-c4cc(COC)c(OC)c(COC)c4)cc3COC)c(C)c2)cc1C.COC.COC.COCc1cc(-c2cc(COC)c(OCC(O)COC)c(COC)c2)cc(COC)c1OC.c1ccc2ccccc2c1.c1ccc2ccccc2c1.c1ccc2ccccc2c1
InChIInChI=1S/C49H64O10.C44H58O10.C32H50O10.C25H36O8.3C10H8.C5H12O2.2C2H6O/c1-11-14-33-24-41(16-18-45(33)57-30-43(50)13-3)49(4,5)42-17-19-46(34(25-42)15-12-2)58-31-44(51)32-59-48-39(28-54-8)22-36(23-40(48)29-55-9)35-20-37(26-52-6)47(56-10)38(21-35)27-53-7;1-11-39(45)24-52-41-27(2)12-31(13-28(41)3)32-14-29(4)42(30(5)15-32)53-25-40(46)26-54-44-37(22-49-8)18-34(19-38(44)23-50-9)33-16-35(20-47-6)43(51-10)36(17-33)21-48-7;1-7-29(33)20-40-10-8-9-11-41-21-30(34)22-42-32-27(18-37-4)14-24(15-28(32)19-38-5)23-12-25(16-35-2)31(39-6)26(13-23)17-36-3;1-27-11-19-7-17(8-20(12-28-2)24(19)32-6)18-9-21(13-29-3)25(22(10-18)14-30-4)33-16-23(26)15-31-5;3*1-2-6-10-8-4-3-7-9(10)5-1;1-3-5(6)4-7-2;2*1-3-2/h11-12,16-25,43-44,50-51H,1-2,13-15,26-32H2,3-10H3;12-19,39-40,45-46H,11,20-26H2,1-10H3;12-15,29-30,33-34H,7-11,16-22H2,1-6H3;7-10,23,26H,11-16H2,1-6H3;3*1-8H;5-6H,3-4H2,1-2H3;2*1-2H3
InChIKeyKBNATDAYVJXGBE-UHFFFAOYSA-N
MW3200.08 g/mol
LogP33.57
Rot. Bonds88

About 1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene

1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene (PubChem CID 165013617) has the molecular formula C189H256O42 and a molecular weight of 3200.08 g/mol. Its IUPAC name is 1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene.

Molecular Properties

Compound Name1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene
PubChem CID165013617
Molecular FormulaC189H256O42
Molecular Weight3200.08 g/mol
Exact Mass3197.79
IUPAC Name1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene
SMILESC=CCc1cc(C(C)(C)c2ccc(OCC(O)COc3c(COC)cc(-c4cc(COC)c(OC)c(COC)c4)cc3COC)c(CC=C)c2)ccc1OCC(O)CC.CCC(O)COC.CCC(O)COCCCCOCC(O)COc1c(COC)cc(-c2cc(COC)c(OC)c(COC)c2)cc1COC.CCC(O)COc1c(C)cc(-c2cc(C)c(OCC(O)COc3c(COC)cc(-c4cc(COC)c(OC)c(COC)c4)cc3COC)c(C)c2)cc1C.COC.COC.COCc1cc(-c2cc(COC)c(OCC(O)COC)c(COC)c2)cc(COC)c1OC.c1ccc2ccccc2c1.c1ccc2ccccc2c1.c1ccc2ccccc2c1
InChIInChI=1S/C49H64O10.C44H58O10.C32H50O10.C25H36O8.3C10H8.C5H12O2.2C2H6O/c1-11-14-33-24-41(16-18-45(33)57-30-43(50)13-3)49(4,5)42-17-19-46(34(25-42)15-12-2)58-31-44(51)32-59-48-39(28-54-8)22-36(23-40(48)29-55-9)35-20-37(26-52-6)47(56-10)38(21-35)27-53-7;1-11-39(45)24-52-41-27(2)12-31(13-28(41)3)32-14-29(4)42(30(5)15-32)53-25-40(46)26-54-44-37(22-49-8)18-34(19-38(44)23-50-9)33-16-35(20-47-6)43(51-10)36(17-33)21-48-7;1-7-29(33)20-40-10-8-9-11-41-21-30(34)22-42-32-27(18-37-4)14-24(15-28(32)19-38-5)23-12-25(16-35-2)31(39-6)26(13-23)17-36-3;1-27-11-19-7-17(8-20(12-28-2)24(19)32-6)18-9-21(13-29-3)25(22(10-18)14-30-4)33-16-23(26)15-31-5;3*1-2-6-10-8-4-3-7-9(10)5-1;1-3-5(6)4-7-2;2*1-3-2/h11-12,16-25,43-44,50-51H,1-2,13-15,26-32H2,3-10H3;12-19,39-40,45-46H,11,20-26H2,1-10H3;12-15,29-30,33-34H,7-11,16-22H2,1-6H3;7-10,23,26H,11-16H2,1-6H3;3*1-8H;5-6H,3-4H2,1-2H3;2*1-2H3
InChIKeyKBNATDAYVJXGBE-UHFFFAOYSA-N
XLogP33.57
TPSA475.66 Ų
H-Bond Donors8
H-Bond Acceptors42
Rotatable Bonds88
Heavy Atoms231
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003200.08
LogP ≤ 533.57
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1042

Computed Properties (RDKit)

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

Analyze 1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene with MolForge

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Launch Full Analysis

Related Compounds

2-[4,6-bis(2,4-dimethylphenyl)-1,3,5-triazin-2-yl]-5-[3-[4-[2-[4-[3-[4-[4,6-bis(2,4-dimethylphenyl)-1,3,5-triazin-2-yl]-3-hydroxyphenoxy]-2-hydroxypropoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]-2-hydroxypropoxy]phenol
CID 176837689
1-(2-methoxyethoxy)-4-[2-(4-methyl-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene
CID 144907753
1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene
CID 19042683
anisole;butane;ethane;1-methoxy-4-[2-(4-methoxy-3-prop-2-enylphenyl)propan-2-yl]-2-prop-2-enylbenzene;1-methoxy-2-methylbenzene;3-methylhexane;2-methylpentane;1-[(2-methylphenyl)methoxy]-3-prop-2-enoxypropan-2-ol;1-phenylmethoxy-3-prop-2-enoxypropan-2-ol;propane
CID 90807525
(2S)-1-butoxy-3-[4-[2-[4-[(2R)-3-chloro-2-methylpropoxy]-3-methylphenyl]propan-2-yl]phenoxy]propan-2-ol
CID 118052763
3-[4-[2-[4-(2,3-dihydroxypropoxy)-3-prop-2-enylphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-prop-2-enylphenoxy]propane-1,2-diol
CID 87077001
1-[4-[9-[4-[3-[4-[4-ethoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]-2-hydroxypropoxy]phenyl]fluoren-9-yl]phenoxy]-4,4-dimethylpentan-2-ol
CID 167069820
1-[(2-fluorophenyl)methoxy]-3-(2-methoxy-4-methylphenoxy)propan-2-ol
CID 109414144
1-(2-ethylhexoxy)-3-[4-[4-(3-heptan-3-yloxy-2-hydroxypropoxy)-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol
CID 165073094
1-[2-(aminomethyl)-4-fluorophenoxy]-3-butoxypropan-2-ol
CID 107694736
3-O-[2-[[4-(8-formylnaphthalen-2-yl)oxy-3-hydroxycyclohexyl]methoxy]-2-oxoethyl] 1-O-[6-[[4-(1-formylnaphthalen-2-yl)oxy-3-hydroxycyclohexyl]methoxy]-6-oxohexyl] 4-O-[2-[[3-hydroxy-4-(1-methoxynaphthalen-2-yl)oxycyclohexyl]methoxy]-2-oxoethyl] 2-O-[2-[[3-hydroxy-4-(8-methoxynaphthalen-2-yl)oxycyclohexyl]methoxy]-2-oxoethyl] butane-1,2,3,4-tetracarboxylate;2-[3-[4-[9-[4-[3-(1-formylnaphthalen-2-yl)oxy-2-hydroxypropoxy]phenyl]fluoren-9-yl]phenoxy]-2-hydroxypropoxy]naphthalene-1-carbaldehyde;2-[3-[4-[2-[4-[3-(1-formylnaphthalen-2-yl)oxy-2-hydroxypropoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]-2-hydroxypropoxy]naphthalene-1-carbaldehyde
CID 167616479
1-[1-[2-(oxiran-2-ylmethoxy)naphthalen-1-yl]naphthalen-2-yl]oxy-3-(2-prop-2-enylphenoxy)propan-2-ol
CID 102120197

Frequently Asked Questions

What is the IUPAC name of 1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene?
The IUPAC name of 1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene (CID 165013617) is 1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene.
What is the SMILES notation for 1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene?
The canonical SMILES for 1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene is C=CCc1cc(C(C)(C)c2ccc(OCC(O)COc3c(COC)cc(-c4cc(COC)c(OC)c(COC)c4)cc3COC)c(CC=C)c2)ccc1OCC(O)CC.CCC(O)COC.CCC(O)COCCCCOCC(O)COc1c(COC)cc(-c2cc(COC)c(OC)c(COC)c2)cc1COC.CCC(O)COc1c(C)cc(-c2cc(C)c(OCC(O)COc3c(COC)cc(-c4cc(COC)c(OC)c(COC)c4)cc3COC)c(C)c2)cc1C.COC.COC.COCc1cc(-c2cc(COC)c(OCC(O)COC)c(COC)c2)cc(COC)c1OC.c1ccc2ccccc2c1.c1ccc2ccccc2c1.c1ccc2ccccc2c1.
What is the InChIKey of 1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene?
The InChIKey is KBNATDAYVJXGBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H64O10.C44H58O10.C32H50O10.C25H36O8.3C10H8.C5H12O2.2C2H6O/c1-11-14-33-24-41(16-18-45(33)57-30-43(50)13-3)49(4,5)42-17-19-46(34(25-42)15-12-2)58-31-44(51)32-59-48-39(28-54-8)22-36(23-40(48)29-55-9)35-20-37(26-52-6)47(56-10)38(21-35)27-53-7;1-11-39(45)24-52-41-27(2)12-31(13-28(41)3)32-14-29(4)42(30(5)15-32)53-25-40(46)26-54-44-37(22-49-8)18-34(19-38(44)23-50-9)33-16-35(20-47-6)43(51-10)36(17-33)21-48-7;1-7-29(33)20-40-10-8-9-11-41-21-30(34)22-42-32-27(18-37-4)14-24(15-28(32)19-38-5)23-12-25(16-35-2)31(39-6)26(13-23)17-36-3;1-27-11-19-7-17(8-20(12-28-2)24(19)32-6)18-9-21(13-29-3)25(22(10-18)14-30-4)33-16-23(26)15-31-5;3*1-2-6-10-8-4-3-7-9(10)5-1;1-3-5(6)4-7-2;2*1-3-2/h11-12,16-25,43-44,50-51H,1-2,13-15,26-32H2,3-10H3;12-19,39-40,45-46H,11,20-26H2,1-10H3;12-15,29-30,33-34H,7-11,16-22H2,1-6H3;7-10,23,26H,11-16H2,1-6H3;3*1-8H;5-6H,3-4H2,1-2H3;2*1-2H3.
What are the key properties of 1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene?
1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene has a molecular weight of 3200.08 g/mol, XLogP of 33.57, 88 rotatable bonds, 8 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]butoxy]butan-2-ol;1-[4-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3,5-dimethylphenyl]-2,6-dimethylphenoxy]butan-2-ol;1-[4-[2-[4-[2-hydroxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propoxy]-3-prop-2-enylphenyl]propan-2-yl]-2-prop-2-enylphenoxy]butan-2-ol;1-methoxybutan-2-ol;methoxymethane;1-methoxy-3-[4-[4-methoxy-3,5-bis(methoxymethyl)phenyl]-2,6-bis(methoxymethyl)phenoxy]propan-2-ol;naphthalene is sourced from PubChem (CID 165013617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).