(4-bromophenyl)-(4-chlorophenyl)methanol;ethane

C15H16BrClO — CID 143569170

IUPAC(4-bromophenyl)-(4-chlorophenyl)methanol;ethane
SMILESCC.OC(c1ccc(Cl)cc1)c1ccc(Br)cc1
InChIInChI=1S/C13H10BrClO.C2H6/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10;1-2/h1-8,13,16H;1-2H3
InChIKeyFAVKPRONAUKMRS-UHFFFAOYSA-N
MW327.65 g/mol
LogP5.21
Rot. Bonds2

About (4-bromophenyl)-(4-chlorophenyl)methanol;ethane

(4-bromophenyl)-(4-chlorophenyl)methanol;ethane (PubChem CID 143569170) has the molecular formula C15H16BrClO and a molecular weight of 327.65 g/mol. Its IUPAC name is (4-bromophenyl)-(4-chlorophenyl)methanol;ethane.

Molecular Properties

Compound Name(4-bromophenyl)-(4-chlorophenyl)methanol;ethane
PubChem CID143569170
Molecular FormulaC15H16BrClO
Molecular Weight327.65 g/mol
Exact Mass326.01
IUPAC Name(4-bromophenyl)-(4-chlorophenyl)methanol;ethane
SMILESCC.OC(c1ccc(Cl)cc1)c1ccc(Br)cc1
InChIInChI=1S/C13H10BrClO.C2H6/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10;1-2/h1-8,13,16H;1-2H3
InChIKeyFAVKPRONAUKMRS-UHFFFAOYSA-N
XLogP5.21
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.65
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-bromo-4-[(S)-chloro-(4-chlorophenyl)methyl]benzene
CID 94201521
1-bromo-4-chlorobenzene
CID 7806
4-[(4-bromophenyl)-hydroxymethyl]phenol
CID 146871813
(S)-(4-bromophenyl)-phenylmethanol
CID 778571
(3-bromo-4-fluorophenyl)-(4-bromophenyl)methanol
CID 79746542
(4-bromophenyl)-(4-chloro-2-fluorophenyl)methanol
CID 61101398
(S)-(4-chlorophenyl)-(3,5-dichlorophenyl)methanol
CID 26595568
(R)-(4-chlorophenyl)-(3,5-dichlorophenyl)methanol
CID 26595571
N-[(1S)-1-(4-bromophenyl)ethyl]-1-(4-chlorophenyl)ethanamine
CID 81359219
(R)-(4-bromophenyl)-(4-methylsulfanylphenyl)methanol
CID 97056034
(2-bromo-4,5-dimethylphenyl)-(4-chlorophenyl)methanol
CID 139494105
2-(4-bromophenyl)sulfanyl-1-(4-chlorophenyl)ethanol
CID 11843613

Frequently Asked Questions

What is the IUPAC name of (4-bromophenyl)-(4-chlorophenyl)methanol;ethane?
The IUPAC name of (4-bromophenyl)-(4-chlorophenyl)methanol;ethane (CID 143569170) is (4-bromophenyl)-(4-chlorophenyl)methanol;ethane.
What is the SMILES notation for (4-bromophenyl)-(4-chlorophenyl)methanol;ethane?
The canonical SMILES for (4-bromophenyl)-(4-chlorophenyl)methanol;ethane is CC.OC(c1ccc(Cl)cc1)c1ccc(Br)cc1.
What is the InChIKey of (4-bromophenyl)-(4-chlorophenyl)methanol;ethane?
The InChIKey is FAVKPRONAUKMRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrClO.C2H6/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10;1-2/h1-8,13,16H;1-2H3.
What are the key properties of (4-bromophenyl)-(4-chlorophenyl)methanol;ethane?
(4-bromophenyl)-(4-chlorophenyl)methanol;ethane has a molecular weight of 327.65 g/mol, XLogP of 5.21, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromophenyl)-(4-chlorophenyl)methanol;ethane is sourced from PubChem (CID 143569170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).