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

C16H16Br2O — CID 107947548

IUPAC(2,4-dibromophenyl)-(2,4,5-trimethylphenyl)methanol
SMILESCc1cc(C)c(C(O)c2ccc(Br)cc2Br)cc1C
InChIInChI=1S/C16H16Br2O/c1-9-6-11(3)14(7-10(9)2)16(19)13-5-4-12(17)8-15(13)18/h4-8,16,19H,1-3H3
InChIKeyZVFJXLBVQDUZQD-UHFFFAOYSA-N
MW384.11 g/mol
LogP5.22
Rot. Bonds2

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

(2,4-dibromophenyl)-(2,4,5-trimethylphenyl)methanol (PubChem CID 107947548) has the molecular formula C16H16Br2O and a molecular weight of 384.11 g/mol. Its IUPAC name is (2,4-dibromophenyl)-(2,4,5-trimethylphenyl)methanol.

Molecular Properties

Compound Name(2,4-dibromophenyl)-(2,4,5-trimethylphenyl)methanol
PubChem CID107947548
Molecular FormulaC16H16Br2O
Molecular Weight384.11 g/mol
Exact Mass381.96
IUPAC Name(2,4-dibromophenyl)-(2,4,5-trimethylphenyl)methanol
SMILESCc1cc(C)c(C(O)c2ccc(Br)cc2Br)cc1C
InChIInChI=1S/C16H16Br2O/c1-9-6-11(3)14(7-10(9)2)16(19)13-5-4-12(17)8-15(13)18/h4-8,16,19H,1-3H3
InChIKeyZVFJXLBVQDUZQD-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

(2,4-dibromophenyl)-(2,4-dimethylphenyl)methanol
CID 107947470
(2,4-dibromophenyl)-(2,5-dimethylphenyl)methanol
CID 114019435
(5-bromo-2-fluorophenyl)-(2,4,5-trimethylphenyl)methanol
CID 64985386
(5-bromo-2-chlorophenyl)-(2,4,5-trimethylphenyl)methanol
CID 115807083
(4-bromo-2,5-dimethylphenyl)-(2,5-dibromophenyl)methanol
CID 114374820
(2,4-dibromophenyl)-(2,3,4,5,6-pentamethylphenyl)methanol
CID 107955363
(4-bromo-2-methoxyphenyl)-(4-methoxy-2,5-dimethylphenyl)methanol
CID 115831252
(2,4-dibromophenyl)-(3,5-dimethylphenyl)methanol
CID 107947280
(4-bromo-2-methylphenyl)-(2,4-dimethylphenyl)methanol
CID 61101101
(4-bromo-2-methoxyphenyl)-(2,5-dibromo-4-methylphenyl)methanol
CID 115369780
(3-bromo-2,4-dimethoxyphenyl)-(2,4-dibromophenyl)methanol
CID 107947925
(3-bromo-4-methoxyphenyl)-(2,4-dibromophenyl)methanol
CID 107955289

Frequently Asked Questions

What is the IUPAC name of (2,4-dibromophenyl)-(2,4,5-trimethylphenyl)methanol?
The IUPAC name of (2,4-dibromophenyl)-(2,4,5-trimethylphenyl)methanol (CID 107947548) is (2,4-dibromophenyl)-(2,4,5-trimethylphenyl)methanol.
What is the SMILES notation for (2,4-dibromophenyl)-(2,4,5-trimethylphenyl)methanol?
The canonical SMILES for (2,4-dibromophenyl)-(2,4,5-trimethylphenyl)methanol is Cc1cc(C)c(C(O)c2ccc(Br)cc2Br)cc1C.
What is the InChIKey of (2,4-dibromophenyl)-(2,4,5-trimethylphenyl)methanol?
The InChIKey is ZVFJXLBVQDUZQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Br2O/c1-9-6-11(3)14(7-10(9)2)16(19)13-5-4-12(17)8-15(13)18/h4-8,16,19H,1-3H3.
What are the key properties of (2,4-dibromophenyl)-(2,4,5-trimethylphenyl)methanol?
(2,4-dibromophenyl)-(2,4,5-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 (2,4-dibromophenyl)-(2,4,5-trimethylphenyl)methanol is sourced from PubChem (CID 107947548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).