1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol

C12H10Br2O2 — CID 63948398

IUPAC1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol
SMILESCC(O)(c1ccccc1Br)c1occc1Br
InChIInChI=1S/C12H10Br2O2/c1-12(15,11-10(14)6-7-16-11)8-4-2-3-5-9(8)13/h2-7,15H,1H3
InChIKeyYDZGZCJUGNYUQK-UHFFFAOYSA-N
MW346.02 g/mol
LogP4.06
Rot. Bonds2

About 1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol

1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol (PubChem CID 63948398) has the molecular formula C12H10Br2O2 and a molecular weight of 346.02 g/mol. Its IUPAC name is 1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol.

Molecular Properties

Compound Name1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol
PubChem CID63948398
Molecular FormulaC12H10Br2O2
Molecular Weight346.02 g/mol
Exact Mass343.90
IUPAC Name1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol
SMILESCC(O)(c1ccccc1Br)c1occc1Br
InChIInChI=1S/C12H10Br2O2/c1-12(15,11-10(14)6-7-16-11)8-4-2-3-5-9(8)13/h2-7,15H,1H3
InChIKeyYDZGZCJUGNYUQK-UHFFFAOYSA-N
XLogP4.06
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.02
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2-Bromophenyl)-2-furaldehyde
CID 1988450
(Furan-2-yl)(phenyl)methanol
CID 3746348
5-(4-Bromophenyl)-2-furoic acid
CID 741099
(5-Benzylfuran-2-yl)methanol
CID 30149
5-(2-Bromo-4-methylphenyl)-2-furaldehyde
CID 876144
(5-Phenylfuran-2-yl)methanol
CID 960786
(3-Bromo-1-benzofuran-2-yl)methanol
CID 23497351
5-(4-Bromophenyl)-2-furanmethanol
CID 718650
5-(4-Bromo-3-methylphenyl)furan-2-carbaldehyde
CID 799553
Ethyl 5-(4-bromophenyl)furan-2-carboxylate
CID 915758
Benzylfurfuryl alcohol
CID 10419976
4-Bromo-5-phenylfuran-2-carbaldehyde
CID 13465698

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol?
The IUPAC name of 1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol (CID 63948398) is 1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol.
What is the SMILES notation for 1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol?
The canonical SMILES for 1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol is CC(O)(c1ccccc1Br)c1occc1Br.
What is the InChIKey of 1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol?
The InChIKey is YDZGZCJUGNYUQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Br2O2/c1-12(15,11-10(14)6-7-16-11)8-4-2-3-5-9(8)13/h2-7,15H,1H3.
What are the key properties of 1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol?
1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol has a molecular weight of 346.02 g/mol, XLogP of 4.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromofuran-2-yl)-1-(2-bromophenyl)ethanol is sourced from PubChem (CID 63948398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).