3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide)

C216H292FN10O15S3- — CID 159214005

IUPAC3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide)
SMILESCC(C)(C)Cc1ccc(NS(=O)[O-])cc1.CC(C)(C)Cc1ccc2[nH]ncc2c1.CC(C)(C)Cc1coc2ccccc12.CC(C)Cc1c[nH]c2ccccc12.CC(C)Cc1ccc(C(N)=O)cc1.CC(C)Cc1ccc2c(c1)CC(=O)N2.CC(C)Cc1ccc2c(c1)CCC(=O)N2.CC(C)Cc1ccc2c(c1)OCO2.CC(C)Cc1ccc2nc[nH]c2c1.CC(C)Cc1ccc2occc2c1.CC(C)Cc1ccco1.Cc1ccc(C(O)C(C)C)cc1.Cc1ccc(CC(C)(C)C)c(F)c1.Cc1ccc(CC(C)C)cc1.Cc1ccc(CC(C)C)cc1.Cc1ccc(CC(C)C)cc1.Cc1ccc(CC(C)C)cc1.Cc1cccc(CC(C)(C)C)c1.O=S=O.O=S=O.[C-]#[N+]c1ccc(CC(C)C)cc1
InChIInChI=1S/C13H17NO.C13H16O.C12H17F.C12H16N2.C12H15NO.C12H15N.C12H14O.C12H18.C11H14N2.C11H17NO2S.C11H15NO.C11H13N.C11H14O2.C11H16O.4C11H16.C8H12O.2O2S/c1-9(2)7-10-3-5-12-11(8-10)4-6-13(15)14-12;1-13(2,3)8-10-9-14-12-7-5-4-6-11(10)12;1-9-5-6-10(11(13)7-9)8-12(2,3)4;1-12(2,3)7-9-4-5-11-10(6-9)8-13-14-11;1-8(2)5-9-3-4-11-10(6-9)7-12(14)13-11;1-9(2)7-10-8-13-12-6-4-3-5-11(10)12;1-9(2)7-10-3-4-12-11(8-10)5-6-13-12;1-10-6-5-7-11(8-10)9-12(2,3)4;1-8(2)5-9-3-4-10-11(6-9)13-7-12-10;1-11(2,3)8-9-4-6-10(7-5-9)12-15(13)14;1-8(2)7-9-3-5-10(6-4-9)11(12)13;1-9(2)8-10-4-6-11(12-3)7-5-10;1-8(2)5-9-3-4-10-11(6-9)13-7-12-10;1-8(2)11(12)10-6-4-9(3)5-7-10;4*1-9(2)8-11-6-4-10(3)5-7-11;1-7(2)6-8-4-3-5-9-8;2*1-3-2/h3,5,8-9H,4,6-7H2,1-2H3,(H,14,15);4-7,9H,8H2,1-3H3;5-7H,8H2,1-4H3;4-6,8H,7H2,1-3H3,(H,13,14);3-4,6,8H,5,7H2,1-2H3,(H,13,14);3-6,8-9,13H,7H2,1-2H3;3-6,8-9H,7H2,1-2H3;5-8H,9H2,1-4H3;3-4,6-8H,5H2,1-2H3,(H,12,13);4-7,12H,8H2,1-3H3,(H,13,14);3-6,8H,7H2,1-2H3,(H2,12,13);4-7,9H,8H2,1-2H3;3-4,6,8H,5,7H2,1-2H3;4-8,11-12H,1-3H3;4*4-7,9H,8H2,1-3H3;3-5,7H,6H2,1-2H3;;/p-1
InChIKeyIIIIGZFNXIBMSA-UHFFFAOYSA-M
MW3383.97 g/mol
LogP56.50
Rot. Bonds36

About 3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide)

3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide) (PubChem CID 159214005) has the molecular formula C216H292FN10O15S3- and a molecular weight of 3383.97 g/mol. Its IUPAC name is 3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide).

Molecular Properties

Compound Name3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide)
PubChem CID159214005
Molecular FormulaC216H292FN10O15S3-
Molecular Weight3383.97 g/mol
Exact Mass3381.15
IUPAC Name3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide)
SMILESCC(C)(C)Cc1ccc(NS(=O)[O-])cc1.CC(C)(C)Cc1ccc2[nH]ncc2c1.CC(C)(C)Cc1coc2ccccc12.CC(C)Cc1c[nH]c2ccccc12.CC(C)Cc1ccc(C(N)=O)cc1.CC(C)Cc1ccc2c(c1)CC(=O)N2.CC(C)Cc1ccc2c(c1)CCC(=O)N2.CC(C)Cc1ccc2c(c1)OCO2.CC(C)Cc1ccc2nc[nH]c2c1.CC(C)Cc1ccc2occc2c1.CC(C)Cc1ccco1.Cc1ccc(C(O)C(C)C)cc1.Cc1ccc(CC(C)(C)C)c(F)c1.Cc1ccc(CC(C)C)cc1.Cc1ccc(CC(C)C)cc1.Cc1ccc(CC(C)C)cc1.Cc1ccc(CC(C)C)cc1.Cc1cccc(CC(C)(C)C)c1.O=S=O.O=S=O.[C-]#[N+]c1ccc(CC(C)C)cc1
InChIInChI=1S/C13H17NO.C13H16O.C12H17F.C12H16N2.C12H15NO.C12H15N.C12H14O.C12H18.C11H14N2.C11H17NO2S.C11H15NO.C11H13N.C11H14O2.C11H16O.4C11H16.C8H12O.2O2S/c1-9(2)7-10-3-5-12-11(8-10)4-6-13(15)14-12;1-13(2,3)8-10-9-14-12-7-5-4-6-11(10)12;1-9-5-6-10(11(13)7-9)8-12(2,3)4;1-12(2,3)7-9-4-5-11-10(6-9)8-13-14-11;1-8(2)5-9-3-4-11-10(6-9)7-12(14)13-11;1-9(2)7-10-8-13-12-6-4-3-5-11(10)12;1-9(2)7-10-3-4-12-11(8-10)5-6-13-12;1-10-6-5-7-11(8-10)9-12(2,3)4;1-8(2)5-9-3-4-10-11(6-9)13-7-12-10;1-11(2,3)8-9-4-6-10(7-5-9)12-15(13)14;1-8(2)7-9-3-5-10(6-4-9)11(12)13;1-9(2)8-10-4-6-11(12-3)7-5-10;1-8(2)5-9-3-4-10-11(6-9)13-7-12-10;1-8(2)11(12)10-6-4-9(3)5-7-10;4*1-9(2)8-11-6-4-10(3)5-7-11;1-7(2)6-8-4-3-5-9-8;2*1-3-2/h3,5,8-9H,4,6-7H2,1-2H3,(H,14,15);4-7,9H,8H2,1-3H3;5-7H,8H2,1-4H3;4-6,8H,7H2,1-3H3,(H,13,14);3-4,6,8H,5,7H2,1-2H3,(H,13,14);3-6,8-9,13H,7H2,1-2H3;3-6,8-9H,7H2,1-2H3;5-8H,9H2,1-4H3;3-4,6-8H,5H2,1-2H3,(H,12,13);4-7,12H,8H2,1-3H3,(H,13,14);3-6,8H,7H2,1-2H3,(H2,12,13);4-7,9H,8H2,1-2H3;3-4,6,8H,5,7H2,1-2H3;4-8,11-12H,1-3H3;4*4-7,9H,8H2,1-3H3;3-5,7H,6H2,1-2H3;;/p-1
InChIKeyIIIIGZFNXIBMSA-UHFFFAOYSA-M
XLogP56.50
TPSA377.35 Ų
H-Bond Donors8
H-Bond Acceptors17
Rotatable Bonds36
Heavy Atoms245
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003383.97
LogP ≤ 556.50
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}

Analyze 3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide)?
The IUPAC name of 3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide) (CID 159214005) is 3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide).
What is the SMILES notation for 3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide)?
The canonical SMILES for 3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide) is CC(C)(C)Cc1ccc(NS(=O)[O-])cc1.CC(C)(C)Cc1ccc2[nH]ncc2c1.CC(C)(C)Cc1coc2ccccc12.CC(C)Cc1c[nH]c2ccccc12.CC(C)Cc1ccc(C(N)=O)cc1.CC(C)Cc1ccc2c(c1)CC(=O)N2.CC(C)Cc1ccc2c(c1)CCC(=O)N2.CC(C)Cc1ccc2c(c1)OCO2.CC(C)Cc1ccc2nc[nH]c2c1.CC(C)Cc1ccc2occc2c1.CC(C)Cc1ccco1.Cc1ccc(C(O)C(C)C)cc1.Cc1ccc(CC(C)(C)C)c(F)c1.Cc1ccc(CC(C)C)cc1.Cc1ccc(CC(C)C)cc1.Cc1ccc(CC(C)C)cc1.Cc1ccc(CC(C)C)cc1.Cc1cccc(CC(C)(C)C)c1.O=S=O.O=S=O.[C-]#[N+]c1ccc(CC(C)C)cc1.
What is the InChIKey of 3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide)?
The InChIKey is IIIIGZFNXIBMSA-UHFFFAOYSA-M. The full InChI is InChI=1S/C13H17NO.C13H16O.C12H17F.C12H16N2.C12H15NO.C12H15N.C12H14O.C12H18.C11H14N2.C11H17NO2S.C11H15NO.C11H13N.C11H14O2.C11H16O.4C11H16.C8H12O.2O2S/c1-9(2)7-10-3-5-12-11(8-10)4-6-13(15)14-12;1-13(2,3)8-10-9-14-12-7-5-4-6-11(10)12;1-9-5-6-10(11(13)7-9)8-12(2,3)4;1-12(2,3)7-9-4-5-11-10(6-9)8-13-14-11;1-8(2)5-9-3-4-11-10(6-9)7-12(14)13-11;1-9(2)7-10-8-13-12-6-4-3-5-11(10)12;1-9(2)7-10-3-4-12-11(8-10)5-6-13-12;1-10-6-5-7-11(8-10)9-12(2,3)4;1-8(2)5-9-3-4-10-11(6-9)13-7-12-10;1-11(2,3)8-9-4-6-10(7-5-9)12-15(13)14;1-8(2)7-9-3-5-10(6-4-9)11(12)13;1-9(2)8-10-4-6-11(12-3)7-5-10;1-8(2)5-9-3-4-10-11(6-9)13-7-12-10;1-8(2)11(12)10-6-4-9(3)5-7-10;4*1-9(2)8-11-6-4-10(3)5-7-11;1-7(2)6-8-4-3-5-9-8;2*1-3-2/h3,5,8-9H,4,6-7H2,1-2H3,(H,14,15);4-7,9H,8H2,1-3H3;5-7H,8H2,1-4H3;4-6,8H,7H2,1-3H3,(H,13,14);3-4,6,8H,5,7H2,1-2H3,(H,13,14);3-6,8-9,13H,7H2,1-2H3;3-6,8-9H,7H2,1-2H3;5-8H,9H2,1-4H3;3-4,6-8H,5H2,1-2H3,(H,12,13);4-7,12H,8H2,1-3H3,(H,13,14);3-6,8H,7H2,1-2H3,(H2,12,13);4-7,9H,8H2,1-2H3;3-4,6,8H,5,7H2,1-2H3;4-8,11-12H,1-3H3;4*4-7,9H,8H2,1-3H3;3-5,7H,6H2,1-2H3;;/p-1.
What are the key properties of 3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide)?
3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide) has a molecular weight of 3383.97 g/mol, XLogP of 56.50, 36 rotatable bonds, 8 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-dimethylpropyl)-1-benzofuran;1-(2,2-dimethylpropyl)-2-fluoro-4-methylbenzene;5-(2,2-dimethylpropyl)-1H-indazole;1-(2,2-dimethylpropyl)-3-methylbenzene;1-(2,2-dimethylpropyl)-4-(sulfinatoamino)benzene;1-isocyano-4-(2-methylpropyl)benzene;2-methyl-1-(4-methylphenyl)propan-1-ol;tetrakis(1-methyl-4-(2-methylpropyl)benzene);4-(2-methylpropyl)benzamide;6-(2-methylpropyl)-1H-benzimidazole;5-(2-methylpropyl)-1,3-benzodioxole;5-(2-methylpropyl)-1-benzofuran;5-(2-methylpropyl)-1,3-dihydroindol-2-one;6-(2-methylpropyl)-3,4-dihydro-1H-quinolin-2-one;2-(2-methylpropyl)furan;3-(2-methylpropyl)-1H-indole;bis(sulfur dioxide) is sourced from PubChem (CID 159214005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).