(3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone

C11H9BrO3 — CID 114973336

IUPAC(3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone
SMILESCCc1ccc(C(=O)c2occc2Br)o1
InChIInChI=1S/C11H9BrO3/c1-2-7-3-4-9(15-7)10(13)11-8(12)5-6-14-11/h3-6H,2H2,1H3
InChIKeyGIHOMUNSTCCHCO-UHFFFAOYSA-N
MW269.09 g/mol
LogP3.43
Rot. Bonds3

About (3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone

(3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone (PubChem CID 114973336) has the molecular formula C11H9BrO3 and a molecular weight of 269.09 g/mol. Its IUPAC name is (3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone.

Molecular Properties

Compound Name(3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone
PubChem CID114973336
Molecular FormulaC11H9BrO3
Molecular Weight269.09 g/mol
Exact Mass267.97
IUPAC Name(3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone
SMILESCCc1ccc(C(=O)c2occc2Br)o1
InChIInChI=1S/C11H9BrO3/c1-2-7-3-4-9(15-7)10(13)11-8(12)5-6-14-11/h3-6H,2H2,1H3
InChIKeyGIHOMUNSTCCHCO-UHFFFAOYSA-N
XLogP3.43
TPSA43.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.09
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone
CID 106683821
3-bromofuran-2-carbonyl bromide
CID 88622824
(4-bromo-5-methylthiophen-2-yl)-(5-ethylfuran-2-yl)methanone
CID 102826505
1-(3-bromofuran-2-yl)butan-1-one
CID 63941447
1-(5-ethylfuran-2-yl)prop-2-yn-1-one
CID 114978456
(4-bromo-1-propan-2-ylpyrazol-5-yl)-(5-ethylfuran-2-yl)methanone
CID 115805217
(3-bromofuran-2-yl)-(4-ethylthiadiazol-5-yl)methanone
CID 105101724
(3-bromo-4-propoxyphenyl)-(5-ethylfuran-2-yl)methanone
CID 104656982
1-(5-ethylfuran-2-yl)butan-1-one
CID 62344781
5-ethyl-N-methylfuran-2-carboxamide
CID 60751451
[3-bromo-4-(2-methoxyethoxy)phenyl]-(5-ethylfuran-2-yl)methanone
CID 104657127
[4-bromo-2-(trifluoromethyl)phenyl]-(5-ethylfuran-2-yl)methanone
CID 107332667

Frequently Asked Questions

What is the IUPAC name of (3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone?
The IUPAC name of (3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone (CID 114973336) is (3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone.
What is the SMILES notation for (3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone?
The canonical SMILES for (3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone is CCc1ccc(C(=O)c2occc2Br)o1.
What is the InChIKey of (3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone?
The InChIKey is GIHOMUNSTCCHCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrO3/c1-2-7-3-4-9(15-7)10(13)11-8(12)5-6-14-11/h3-6H,2H2,1H3.
What are the key properties of (3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone?
(3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone has a molecular weight of 269.09 g/mol, XLogP of 3.43, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone is sourced from PubChem (CID 114973336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).