(3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol

C16H16Br2O — CID 107980714

IUPAC(3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol
SMILESCc1cc(C)c(C(O)c2cc(Br)cc(Br)c2)c(C)c1
InChIInChI=1S/C16H16Br2O/c1-9-4-10(2)15(11(3)5-9)16(19)12-6-13(17)8-14(18)7-12/h4-8,16,19H,1-3H3
InChIKeyFNZWQLMGNMRIEO-UHFFFAOYSA-N
MW384.11 g/mol
LogP5.22
Rot. Bonds2

About (3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol

(3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol (PubChem CID 107980714) has the molecular formula C16H16Br2O and a molecular weight of 384.11 g/mol. Its IUPAC name is (3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol.

Molecular Properties

Compound Name(3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol
PubChem CID107980714
Molecular FormulaC16H16Br2O
Molecular Weight384.11 g/mol
Exact Mass381.96
IUPAC Name(3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol
SMILESCc1cc(C)c(C(O)c2cc(Br)cc(Br)c2)c(C)c1
InChIInChI=1S/C16H16Br2O/c1-9-4-10(2)15(11(3)5-9)16(19)12-6-13(17)8-14(18)7-12/h4-8,16,19H,1-3H3
InChIKeyFNZWQLMGNMRIEO-UHFFFAOYSA-N
XLogP5.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.11
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3-bromo-5-methylphenyl)-(4-fluoro-2,6-dimethylphenyl)methanol
CID 106879416
(3,5-dibromophenyl)-(2,3,4,5,6-pentamethylphenyl)methanol
CID 107980708
(5-bromothiophen-3-yl)-(2,4,6-trimethylphenyl)methanol
CID 114021555
1-(3,5-dibromophenyl)-2-(2,4,6-trimethylphenyl)ethanol
CID 107978212
(3-bromophenyl)-(2-methoxy-4,6-dimethylphenyl)methanol
CID 106679553
(3-bromo-5-chlorophenyl)-(2,3,5,6-tetramethylphenyl)methanol
CID 107955397
(3-bromo-5-methylphenyl)-(2,5-dimethylphenyl)methanol
CID 113460971
(5-methylthiophen-3-yl)-(2,4,6-trimethylphenyl)methanol
CID 65099676
(3-bromo-5-methylphenyl)-(3,5-difluorophenyl)methanol
CID 115793225
(4-bromo-2,6-dimethylphenyl)methanediol
CID 21336315
(3-bromo-2,6-difluorophenyl)-(3-bromo-5-methylphenyl)methanol
CID 106945118
1-(3-bromo-5-methylphenyl)ethanol
CID 84680750

Frequently Asked Questions

What is the IUPAC name of (3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol?
The IUPAC name of (3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol (CID 107980714) is (3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol.
What is the SMILES notation for (3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol?
The canonical SMILES for (3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol is Cc1cc(C)c(C(O)c2cc(Br)cc(Br)c2)c(C)c1.
What is the InChIKey of (3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol?
The InChIKey is FNZWQLMGNMRIEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Br2O/c1-9-4-10(2)15(11(3)5-9)16(19)12-6-13(17)8-14(18)7-12/h4-8,16,19H,1-3H3.
What are the key properties of (3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol?
(3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol has a molecular weight of 384.11 g/mol, XLogP of 5.22, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dibromophenyl)-(2,4,6-trimethylphenyl)methanol is sourced from PubChem (CID 107980714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).