2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol

C14H12BrClO — CID 61029924

IUPAC2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol
SMILESOC(Cc1cccc(Br)c1)c1ccccc1Cl
InChIInChI=1S/C14H12BrClO/c15-11-5-3-4-10(8-11)9-14(17)12-6-1-2-7-13(12)16/h1-8,14,17H,9H2
InChIKeyDJOYPPSMYNCXDR-UHFFFAOYSA-N
MW311.61 g/mol
LogP4.38
Rot. Bonds3

About 2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol

2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol (PubChem CID 61029924) has the molecular formula C14H12BrClO and a molecular weight of 311.61 g/mol. Its IUPAC name is 2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol.

Molecular Properties

Compound Name2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol
PubChem CID61029924
Molecular FormulaC14H12BrClO
Molecular Weight311.61 g/mol
Exact Mass309.98
IUPAC Name2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol
SMILESOC(Cc1cccc(Br)c1)c1ccccc1Cl
InChIInChI=1S/C14H12BrClO/c15-11-5-3-4-10(8-11)9-14(17)12-6-1-2-7-13(12)16/h1-8,14,17H,9H2
InChIKeyDJOYPPSMYNCXDR-UHFFFAOYSA-N
XLogP4.38
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.61
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-bromo-2-fluorophenyl)-1-(2-chlorophenyl)ethanol
CID 62606952
2-(3-chloro-4-fluorophenyl)-1-(2-chlorophenyl)ethanol
CID 103038949
2-(4-chloro-3-fluorophenyl)-1-(2-chlorophenyl)ethanol
CID 107883504
2-(3-bromophenyl)-1-(3-chlorophenyl)ethanol
CID 60797873
2-(3-bromophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 55135398
1-(5-bromo-2-chlorophenyl)-2-(3-methoxyphenyl)ethanol
CID 63018644
2-(3-bromophenyl)-1-[2-[4-[hydroxy(phenyl)methyl]phenyl]phenyl]ethanol
CID 175061046
2-[1-(3-bromophenyl)ethylamino]-1-(2-chlorophenyl)ethanol
CID 60970927
(1R)-1,2-bis(2-chlorophenyl)ethanol
CID 86310638
1-(3-bromophenyl)but-3-yn-2-ol
CID 115811161
(1R)-2-bromo-1-(2-chlorophenyl)ethanol
CID 25324199
1-(4-bromo-2-methoxyphenyl)-2-(3-bromophenyl)ethanol
CID 115370074

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol?
The IUPAC name of 2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol (CID 61029924) is 2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol.
What is the SMILES notation for 2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol?
The canonical SMILES for 2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol is OC(Cc1cccc(Br)c1)c1ccccc1Cl.
What is the InChIKey of 2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol?
The InChIKey is DJOYPPSMYNCXDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrClO/c15-11-5-3-4-10(8-11)9-14(17)12-6-1-2-7-13(12)16/h1-8,14,17H,9H2.
What are the key properties of 2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol?
2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol has a molecular weight of 311.61 g/mol, XLogP of 4.38, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromophenyl)-1-(2-chlorophenyl)ethanol is sourced from PubChem (CID 61029924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).