1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol

C207H259BrCl2F29NO8 — CID 160598314

IUPAC1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol
SMILESCC(C)(C)c1c(F)ccc(F)c1O.CC(C)(C)c1c(F)cccc1C#N.CC(C)(C)c1c(F)cccc1F.CC(C)(C)c1c(O)cccc1F.CC(C)(C)c1cc(C(C)(C)O)ccc1F.CC(C)(C)c1cc(Cl)ccc1F.CC(C)(C)c1cc(F)ccc1F.CC(C)(C)c1cc(F)ccc1O.CC(C)(C)c1cc(O)c(F)cc1F.CC(C)(C)c1cc(O)ccc1F.CC(C)(C)c1ccc(Br)cc1.CC(C)(C)c1ccc(Cl)cc1F.CC(C)(C)c1ccc(F)cc1.CC(C)(C)c1ccc(F)cc1C(F)(F)F.CC(C)(C)c1ccc(F)cc1F.CC(C)(C)c1ccc(F)cc1O.CC(C)(C)c1ccc(O)cc1C(F)(F)F.CC(C)(C)c1cccc(F)c1.CC(C)(C)c1ccccc1F.Cc1ccc(F)c(C(C)(C)C)c1
InChIInChI=1S/C13H19FO.C11H12F4.C11H13F3O.C11H12FN.C11H15F.C10H13Br.2C10H12ClF.2C10H12F2O.3C10H12F2.4C10H13FO.3C10H13F/c1-12(2,3)10-8-9(13(4,5)15)6-7-11(10)14;1-10(2,3)8-5-4-7(12)6-9(8)11(13,14)15;1-10(2,3)8-5-4-7(15)6-9(8)11(12,13)14;1-11(2,3)10-8(7-13)5-4-6-9(10)12;1-8-5-6-10(12)9(7-8)11(2,3)4;1-10(2,3)8-4-6-9(11)7-5-8;1-10(2,3)8-6-7(11)4-5-9(8)12;1-10(2,3)8-5-4-7(11)6-9(8)12;1-10(2,3)6-4-9(13)8(12)5-7(6)11;1-10(2,3)8-6(11)4-5-7(12)9(8)13;1-10(2,3)8-6-7(11)4-5-9(8)12;1-10(2,3)8-5-4-7(11)6-9(8)12;1-10(2,3)9-7(11)5-4-6-8(9)12;1-10(2,3)8-6-7(12)4-5-9(8)11;1-10(2,3)8-6-7(11)4-5-9(8)12;1-10(2,3)8-5-4-7(11)6-9(8)12;1-10(2,3)9-7(11)5-4-6-8(9)12;1-10(2,3)8-4-6-9(11)7-5-8;1-10(2,3)8-5-4-6-9(11)7-8;1-10(2,3)8-6-4-5-7-9(8)11/h6-8,15H,1-5H3;4-6H,1-3H3;4-6,15H,1-3H3;4-6H,1-3H3;5-7H,1-4H3;4-7H,1-3H3;2*4-6H,1-3H3;2*4-5,13H,1-3H3;3*4-6H,1-3H3;4*4-6,12H,1-3H3;3*4-7H,1-3H3
InChIKeyRDXYNGJOYONCEP-UHFFFAOYSA-N
MW3591.10 g/mol
LogP65.33
Rot. Bonds1

About 1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol

1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol (PubChem CID 160598314) has the molecular formula C207H259BrCl2F29NO8 and a molecular weight of 3591.10 g/mol. Its IUPAC name is 1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol.

Molecular Properties

Compound Name1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol
PubChem CID160598314
Molecular FormulaC207H259BrCl2F29NO8
Molecular Weight3591.10 g/mol
Exact Mass3586.80
IUPAC Name1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol
SMILESCC(C)(C)c1c(F)ccc(F)c1O.CC(C)(C)c1c(F)cccc1C#N.CC(C)(C)c1c(F)cccc1F.CC(C)(C)c1c(O)cccc1F.CC(C)(C)c1cc(C(C)(C)O)ccc1F.CC(C)(C)c1cc(Cl)ccc1F.CC(C)(C)c1cc(F)ccc1F.CC(C)(C)c1cc(F)ccc1O.CC(C)(C)c1cc(O)c(F)cc1F.CC(C)(C)c1cc(O)ccc1F.CC(C)(C)c1ccc(Br)cc1.CC(C)(C)c1ccc(Cl)cc1F.CC(C)(C)c1ccc(F)cc1.CC(C)(C)c1ccc(F)cc1C(F)(F)F.CC(C)(C)c1ccc(F)cc1F.CC(C)(C)c1ccc(F)cc1O.CC(C)(C)c1ccc(O)cc1C(F)(F)F.CC(C)(C)c1cccc(F)c1.CC(C)(C)c1ccccc1F.Cc1ccc(F)c(C(C)(C)C)c1
InChIInChI=1S/C13H19FO.C11H12F4.C11H13F3O.C11H12FN.C11H15F.C10H13Br.2C10H12ClF.2C10H12F2O.3C10H12F2.4C10H13FO.3C10H13F/c1-12(2,3)10-8-9(13(4,5)15)6-7-11(10)14;1-10(2,3)8-5-4-7(12)6-9(8)11(13,14)15;1-10(2,3)8-5-4-7(15)6-9(8)11(12,13)14;1-11(2,3)10-8(7-13)5-4-6-9(10)12;1-8-5-6-10(12)9(7-8)11(2,3)4;1-10(2,3)8-4-6-9(11)7-5-8;1-10(2,3)8-6-7(11)4-5-9(8)12;1-10(2,3)8-5-4-7(11)6-9(8)12;1-10(2,3)6-4-9(13)8(12)5-7(6)11;1-10(2,3)8-6(11)4-5-7(12)9(8)13;1-10(2,3)8-6-7(11)4-5-9(8)12;1-10(2,3)8-5-4-7(11)6-9(8)12;1-10(2,3)9-7(11)5-4-6-8(9)12;1-10(2,3)8-6-7(12)4-5-9(8)11;1-10(2,3)8-6-7(11)4-5-9(8)12;1-10(2,3)8-5-4-7(11)6-9(8)12;1-10(2,3)9-7(11)5-4-6-8(9)12;1-10(2,3)8-4-6-9(11)7-5-8;1-10(2,3)8-5-4-6-9(11)7-8;1-10(2,3)8-6-4-5-7-9(8)11/h6-8,15H,1-5H3;4-6H,1-3H3;4-6,15H,1-3H3;4-6H,1-3H3;5-7H,1-4H3;4-7H,1-3H3;2*4-6H,1-3H3;2*4-5,13H,1-3H3;3*4-6H,1-3H3;4*4-6,12H,1-3H3;3*4-7H,1-3H3
InChIKeyRDXYNGJOYONCEP-UHFFFAOYSA-N
XLogP65.33
TPSA185.63 Ų
H-Bond Donors8
H-Bond Acceptors9
Rotatable Bonds1
Heavy Atoms248
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003591.10
LogP ≤ 565.33
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 109

Analyze 1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol?
The IUPAC name of 1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol (CID 160598314) is 1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol.
What is the SMILES notation for 1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol?
The canonical SMILES for 1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol is CC(C)(C)c1c(F)ccc(F)c1O.CC(C)(C)c1c(F)cccc1C#N.CC(C)(C)c1c(F)cccc1F.CC(C)(C)c1c(O)cccc1F.CC(C)(C)c1cc(C(C)(C)O)ccc1F.CC(C)(C)c1cc(Cl)ccc1F.CC(C)(C)c1cc(F)ccc1F.CC(C)(C)c1cc(F)ccc1O.CC(C)(C)c1cc(O)c(F)cc1F.CC(C)(C)c1cc(O)ccc1F.CC(C)(C)c1ccc(Br)cc1.CC(C)(C)c1ccc(Cl)cc1F.CC(C)(C)c1ccc(F)cc1.CC(C)(C)c1ccc(F)cc1C(F)(F)F.CC(C)(C)c1ccc(F)cc1F.CC(C)(C)c1ccc(F)cc1O.CC(C)(C)c1ccc(O)cc1C(F)(F)F.CC(C)(C)c1cccc(F)c1.CC(C)(C)c1ccccc1F.Cc1ccc(F)c(C(C)(C)C)c1.
What is the InChIKey of 1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol?
The InChIKey is RDXYNGJOYONCEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FO.C11H12F4.C11H13F3O.C11H12FN.C11H15F.C10H13Br.2C10H12ClF.2C10H12F2O.3C10H12F2.4C10H13FO.3C10H13F/c1-12(2,3)10-8-9(13(4,5)15)6-7-11(10)14;1-10(2,3)8-5-4-7(12)6-9(8)11(13,14)15;1-10(2,3)8-5-4-7(15)6-9(8)11(12,13)14;1-11(2,3)10-8(7-13)5-4-6-9(10)12;1-8-5-6-10(12)9(7-8)11(2,3)4;1-10(2,3)8-4-6-9(11)7-5-8;1-10(2,3)8-6-7(11)4-5-9(8)12;1-10(2,3)8-5-4-7(11)6-9(8)12;1-10(2,3)6-4-9(13)8(12)5-7(6)11;1-10(2,3)8-6(11)4-5-7(12)9(8)13;1-10(2,3)8-6-7(11)4-5-9(8)12;1-10(2,3)8-5-4-7(11)6-9(8)12;1-10(2,3)9-7(11)5-4-6-8(9)12;1-10(2,3)8-6-7(12)4-5-9(8)11;1-10(2,3)8-6-7(11)4-5-9(8)12;1-10(2,3)8-5-4-7(11)6-9(8)12;1-10(2,3)9-7(11)5-4-6-8(9)12;1-10(2,3)8-4-6-9(11)7-5-8;1-10(2,3)8-5-4-6-9(11)7-8;1-10(2,3)8-6-4-5-7-9(8)11/h6-8,15H,1-5H3;4-6H,1-3H3;4-6,15H,1-3H3;4-6H,1-3H3;5-7H,1-4H3;4-7H,1-3H3;2*4-6H,1-3H3;2*4-5,13H,1-3H3;3*4-6H,1-3H3;4*4-6,12H,1-3H3;3*4-7H,1-3H3.
What are the key properties of 1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol?
1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol has a molecular weight of 3591.10 g/mol, XLogP of 65.33, 1 rotatable bonds, 8 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-4-tert-butylbenzene;1-tert-butyl-4-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;1-tert-butyl-2,4-difluorobenzene;2-tert-butyl-1,3-difluorobenzene;2-tert-butyl-1,4-difluorobenzene;2-tert-butyl-3,6-difluorophenol;5-tert-butyl-2,4-difluorophenol;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;2-tert-butyl-3-fluorobenzonitrile;2-tert-butyl-1-fluoro-4-methylbenzene;2-tert-butyl-3-fluorophenol;2-tert-butyl-4-fluorophenol;2-tert-butyl-5-fluorophenol;3-tert-butyl-4-fluorophenol;2-(3-tert-butyl-4-fluorophenyl)propan-2-ol;1-tert-butyl-4-fluoro-2-(trifluoromethyl)benzene;4-tert-butyl-3-(trifluoromethyl)phenol is sourced from PubChem (CID 160598314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).