(1R)-1-(2-bromophenyl)-1-phenylethanol

C14H13BrO — CID 135056517

IUPAC(1R)-1-(2-bromophenyl)-1-phenylethanol
SMILESC[C@@](O)(c1ccccc1)c1ccccc1Br
InChIInChI=1S/C14H13BrO/c1-14(16,11-7-3-2-4-8-11)12-9-5-6-10-13(12)15/h2-10,16H,1H3/t14-/m1/s1
InChIKeyJABMXOHZXFJZBF-CQSZACIVSA-N
MW277.16 g/mol
LogP3.70
Rot. Bonds2

About (1R)-1-(2-bromophenyl)-1-phenylethanol

(1R)-1-(2-bromophenyl)-1-phenylethanol (PubChem CID 135056517) has the molecular formula C14H13BrO and a molecular weight of 277.16 g/mol. Its IUPAC name is (1R)-1-(2-bromophenyl)-1-phenylethanol.

Molecular Properties

Compound Name(1R)-1-(2-bromophenyl)-1-phenylethanol
PubChem CID135056517
Molecular FormulaC14H13BrO
Molecular Weight277.16 g/mol
Exact Mass276.01
IUPAC Name(1R)-1-(2-bromophenyl)-1-phenylethanol
SMILESC[C@@](O)(c1ccccc1)c1ccccc1Br
InChIInChI=1S/C14H13BrO/c1-14(16,11-7-3-2-4-8-11)12-9-5-6-10-13(12)15/h2-10,16H,1H3/t14-/m1/s1
InChIKeyJABMXOHZXFJZBF-CQSZACIVSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.16
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-(2-bromophenyl)-1-phenylethanol?
The IUPAC name of (1R)-1-(2-bromophenyl)-1-phenylethanol (CID 135056517) is (1R)-1-(2-bromophenyl)-1-phenylethanol.
What is the SMILES notation for (1R)-1-(2-bromophenyl)-1-phenylethanol?
The canonical SMILES for (1R)-1-(2-bromophenyl)-1-phenylethanol is C[C@@](O)(c1ccccc1)c1ccccc1Br.
What is the InChIKey of (1R)-1-(2-bromophenyl)-1-phenylethanol?
The InChIKey is JABMXOHZXFJZBF-CQSZACIVSA-N. The full InChI is InChI=1S/C14H13BrO/c1-14(16,11-7-3-2-4-8-11)12-9-5-6-10-13(12)15/h2-10,16H,1H3/t14-/m1/s1.
What are the key properties of (1R)-1-(2-bromophenyl)-1-phenylethanol?
(1R)-1-(2-bromophenyl)-1-phenylethanol has a molecular weight of 277.16 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(2-bromophenyl)-1-phenylethanol is sourced from PubChem (CID 135056517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).