(5-chlorofuran-2-yl)-(3-ethylphenyl)methanol

C13H13ClO2 — CID 106693920

IUPAC(5-chlorofuran-2-yl)-(3-ethylphenyl)methanol
SMILESCCc1cccc(C(O)c2ccc(Cl)o2)c1
InChIInChI=1S/C13H13ClO2/c1-2-9-4-3-5-10(8-9)13(15)11-6-7-12(14)16-11/h3-8,13,15H,2H2,1H3
InChIKeyHXUMEYXGSDTBQS-UHFFFAOYSA-N
MW236.70 g/mol
LogP3.58
Rot. Bonds3

About (5-chlorofuran-2-yl)-(3-ethylphenyl)methanol

(5-chlorofuran-2-yl)-(3-ethylphenyl)methanol (PubChem CID 106693920) has the molecular formula C13H13ClO2 and a molecular weight of 236.70 g/mol. Its IUPAC name is (5-chlorofuran-2-yl)-(3-ethylphenyl)methanol.

Molecular Properties

Compound Name(5-chlorofuran-2-yl)-(3-ethylphenyl)methanol
PubChem CID106693920
Molecular FormulaC13H13ClO2
Molecular Weight236.70 g/mol
Exact Mass236.06
IUPAC Name(5-chlorofuran-2-yl)-(3-ethylphenyl)methanol
SMILESCCc1cccc(C(O)c2ccc(Cl)o2)c1
InChIInChI=1S/C13H13ClO2/c1-2-9-4-3-5-10(8-9)13(15)11-6-7-12(14)16-11/h3-8,13,15H,2H2,1H3
InChIKeyHXUMEYXGSDTBQS-UHFFFAOYSA-N
XLogP3.58
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.70
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-chlorofuran-2-yl)-(4-propylphenyl)methanol
CID 106688844
(4-butylphenyl)-(5-chlorofuran-2-yl)methanol
CID 106688839
(5-chlorofuran-2-yl)-(3,4-dichlorophenyl)methanol
CID 106688862
(3,5-dibromophenyl)-(3-ethylphenyl)methanol
CID 107978572
(2,4-dibromophenyl)-(3-ethylphenyl)methanol
CID 107947696
(3-ethylphenyl)-(2-iodophenyl)methanol
CID 115823914
(2,5-dibromothiophen-3-yl)-(3-ethylphenyl)methanol
CID 107969813
(3-ethylphenyl)-(methylamino)methanol
CID 91312447
(4-bromo-5-methylthiophen-2-yl)-(3-ethylphenyl)methanol
CID 102829560
(3-ethylphenyl)-(2-ethylpyrazol-3-yl)methanol
CID 114556807
(3-ethylphenyl)-(4-methyl-1,3-thiazol-2-yl)methanol
CID 104769434
(5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol
CID 106693588

Frequently Asked Questions

What is the IUPAC name of (5-chlorofuran-2-yl)-(3-ethylphenyl)methanol?
The IUPAC name of (5-chlorofuran-2-yl)-(3-ethylphenyl)methanol (CID 106693920) is (5-chlorofuran-2-yl)-(3-ethylphenyl)methanol.
What is the SMILES notation for (5-chlorofuran-2-yl)-(3-ethylphenyl)methanol?
The canonical SMILES for (5-chlorofuran-2-yl)-(3-ethylphenyl)methanol is CCc1cccc(C(O)c2ccc(Cl)o2)c1.
What is the InChIKey of (5-chlorofuran-2-yl)-(3-ethylphenyl)methanol?
The InChIKey is HXUMEYXGSDTBQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClO2/c1-2-9-4-3-5-10(8-9)13(15)11-6-7-12(14)16-11/h3-8,13,15H,2H2,1H3.
What are the key properties of (5-chlorofuran-2-yl)-(3-ethylphenyl)methanol?
(5-chlorofuran-2-yl)-(3-ethylphenyl)methanol has a molecular weight of 236.70 g/mol, XLogP of 3.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chlorofuran-2-yl)-(3-ethylphenyl)methanol is sourced from PubChem (CID 106693920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).