(2-bromophenyl)-(4-propan-2-ylphenyl)methanol

C16H17BrO — CID 61083322

IUPAC(2-bromophenyl)-(4-propan-2-ylphenyl)methanol
SMILESCC(C)c1ccc(C(O)c2ccccc2Br)cc1
InChIInChI=1S/C16H17BrO/c1-11(2)12-7-9-13(10-8-12)16(18)14-5-3-4-6-15(14)17/h3-11,16,18H,1-2H3
InChIKeyDPQLEQLMOWZCPY-UHFFFAOYSA-N
MW305.21 g/mol
LogP4.65
Rot. Bonds3

About (2-bromophenyl)-(4-propan-2-ylphenyl)methanol

(2-bromophenyl)-(4-propan-2-ylphenyl)methanol (PubChem CID 61083322) has the molecular formula C16H17BrO and a molecular weight of 305.21 g/mol. Its IUPAC name is (2-bromophenyl)-(4-propan-2-ylphenyl)methanol.

Molecular Properties

Compound Name(2-bromophenyl)-(4-propan-2-ylphenyl)methanol
PubChem CID61083322
Molecular FormulaC16H17BrO
Molecular Weight305.21 g/mol
Exact Mass304.05
IUPAC Name(2-bromophenyl)-(4-propan-2-ylphenyl)methanol
SMILESCC(C)c1ccc(C(O)c2ccccc2Br)cc1
InChIInChI=1S/C16H17BrO/c1-11(2)12-7-9-13(10-8-12)16(18)14-5-3-4-6-15(14)17/h3-11,16,18H,1-2H3
InChIKeyDPQLEQLMOWZCPY-UHFFFAOYSA-N
XLogP4.65
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.21
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-bromophenyl)-[4-(dimethylamino)phenyl]methanol
CID 118122372
(2-iodophenyl)-(4-propan-2-ylphenyl)methanol
CID 61082573
(R)-(2-bromophenyl)-(3,5-dichlorophenyl)methanol
CID 97293471
(1S)-1-(2-bromophenyl)ethanol
CID 6950331
(1S)-1-(2-bromophenyl)ethanol
CID 139073913
(3-bromo-4-fluorophenyl)-(2-bromophenyl)methanol
CID 79746626
2-[hydroxy-(4-propan-2-ylphenyl)methyl]benzoic acid
CID 61023494
(2-bromophenyl)-(3,4-diethylphenyl)methanol
CID 115482670
(2-cyclopropylphenyl)-(4-propan-2-ylphenyl)methanol
CID 79983378
(R)-(2-bromophenyl)-(3-propan-2-yloxyphenyl)methanol
CID 97056028
1-(2-bromophenyl)ethanethiol
CID 43124084
(S)-(2-bromophenyl)-(3-chloro-5-fluorophenyl)methanol
CID 97293464

Frequently Asked Questions

What is the IUPAC name of (2-bromophenyl)-(4-propan-2-ylphenyl)methanol?
The IUPAC name of (2-bromophenyl)-(4-propan-2-ylphenyl)methanol (CID 61083322) is (2-bromophenyl)-(4-propan-2-ylphenyl)methanol.
What is the SMILES notation for (2-bromophenyl)-(4-propan-2-ylphenyl)methanol?
The canonical SMILES for (2-bromophenyl)-(4-propan-2-ylphenyl)methanol is CC(C)c1ccc(C(O)c2ccccc2Br)cc1.
What is the InChIKey of (2-bromophenyl)-(4-propan-2-ylphenyl)methanol?
The InChIKey is DPQLEQLMOWZCPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17BrO/c1-11(2)12-7-9-13(10-8-12)16(18)14-5-3-4-6-15(14)17/h3-11,16,18H,1-2H3.
What are the key properties of (2-bromophenyl)-(4-propan-2-ylphenyl)methanol?
(2-bromophenyl)-(4-propan-2-ylphenyl)methanol has a molecular weight of 305.21 g/mol, XLogP of 4.65, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromophenyl)-(4-propan-2-ylphenyl)methanol is sourced from PubChem (CID 61083322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).