(E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol

C15H13BrO — CID 134972554

IUPAC(E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol
SMILESO[C@H](/C=C/c1ccccc1)c1ccccc1Br
InChIInChI=1S/C15H13BrO/c16-14-9-5-4-8-13(14)15(17)11-10-12-6-2-1-3-7-12/h1-11,15,17H/b11-10+/t15-/m1/s1
InChIKeyHAZWGMGYENVHHW-AUECHBEKSA-N
MW289.17 g/mol
LogP4.20
Rot. Bonds3

About (E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol

(E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol (PubChem CID 134972554) has the molecular formula C15H13BrO and a molecular weight of 289.17 g/mol. Its IUPAC name is (E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol.

Molecular Properties

Compound Name(E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol
PubChem CID134972554
Molecular FormulaC15H13BrO
Molecular Weight289.17 g/mol
Exact Mass288.01
IUPAC Name(E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol
SMILESO[C@H](/C=C/c1ccccc1)c1ccccc1Br
InChIInChI=1S/C15H13BrO/c16-14-9-5-4-8-13(14)15(17)11-10-12-6-2-1-3-7-12/h1-11,15,17H/b11-10+/t15-/m1/s1
InChIKeyHAZWGMGYENVHHW-AUECHBEKSA-N
XLogP4.20
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.17
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Benzhydrol
CID 7037
4-Bromobenzyl alcohol
CID 70119
2-Bromobenzyl alcohol
CID 72850
1,2-Diphenylethanol
CID 94178
(3-Bromophenyl)(phenyl)methanol
CID 285827
1-(4-Bromophenyl)ethanol
CID 95352
3-Bromobenzyl alcohol
CID 85141
1-(2-Bromophenyl)ethanol
CID 95455
p-Bromobenzhydryl alcohol
CID 98221
1-(3-Bromophenyl)ethanol
CID 98479
(4-Bromophenyl)(cyclopropyl)methanol
CID 123566
2-(2-Bromophenyl)propan-2-ol
CID 329527

Frequently Asked Questions

What is the IUPAC name of (E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol?
The IUPAC name of (E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol (CID 134972554) is (E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol.
What is the SMILES notation for (E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol?
The canonical SMILES for (E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol is O[C@H](/C=C/c1ccccc1)c1ccccc1Br.
What is the InChIKey of (E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol?
The InChIKey is HAZWGMGYENVHHW-AUECHBEKSA-N. The full InChI is InChI=1S/C15H13BrO/c16-14-9-5-4-8-13(14)15(17)11-10-12-6-2-1-3-7-12/h1-11,15,17H/b11-10+/t15-/m1/s1.
What are the key properties of (E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol?
(E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol has a molecular weight of 289.17 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E,1R)-1-(2-bromophenyl)-3-phenylprop-2-en-1-ol is sourced from PubChem (CID 134972554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).