furan-3-yl(oxolan-3-yl)methanol

C9H12O3 — CID 63894971

IUPACfuran-3-yl(oxolan-3-yl)methanol
SMILESOC(c1ccoc1)C1CCOC1
InChIInChI=1S/C9H12O3/c10-9(7-1-3-11-5-7)8-2-4-12-6-8/h1,3,5,8-10H,2,4,6H2
InChIKeyBIJLTANTOKFODR-UHFFFAOYSA-N
MW168.19 g/mol
LogP1.35
Rot. Bonds2

About furan-3-yl(oxolan-3-yl)methanol

furan-3-yl(oxolan-3-yl)methanol (PubChem CID 63894971) has the molecular formula C9H12O3 and a molecular weight of 168.19 g/mol. Its IUPAC name is furan-3-yl(oxolan-3-yl)methanol.

Molecular Properties

Compound Namefuran-3-yl(oxolan-3-yl)methanol
PubChem CID63894971
Molecular FormulaC9H12O3
Molecular Weight168.19 g/mol
Exact Mass168.08
IUPAC Namefuran-3-yl(oxolan-3-yl)methanol
SMILESOC(c1ccoc1)C1CCOC1
InChIInChI=1S/C9H12O3/c10-9(7-1-3-11-5-7)8-2-4-12-6-8/h1,3,5,8-10H,2,4,6H2
InChIKeyBIJLTANTOKFODR-UHFFFAOYSA-N
XLogP1.35
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.19
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3,5-dichlorophenyl)-(oxolan-3-yl)methanol
CID 63899921
(4-ethylcyclohexyl)-(furan-3-yl)methanol
CID 64749944
(1-methylpyrazol-4-yl)-(oxolan-3-yl)methanol
CID 61279320
furan-3-yl(oxan-2-yl)methanol
CID 115797283
(6-bromonaphthalen-2-yl)-(oxolan-3-yl)methanol
CID 115798116
oxolan-3-yl-[4-(trifluoromethoxy)phenyl]methanol
CID 63893773
(2-methylfuran-3-yl)-(oxolan-3-yl)methanol
CID 104789574
oxolan-3-yl-(2,3,4-trifluorophenyl)methanol
CID 63893972
oxolan-3-yl-(2,4,6-trifluorophenyl)methanol
CID 61277498
(4-bromophenyl)-(oxan-3-yl)methanol
CID 63015439
(2-fluorophenyl)-(oxolan-3-yl)methanol
CID 63565123
(2-chlorophenyl)-(oxolan-3-yl)methanol
CID 63564171

Frequently Asked Questions

What is the IUPAC name of furan-3-yl(oxolan-3-yl)methanol?
The IUPAC name of furan-3-yl(oxolan-3-yl)methanol (CID 63894971) is furan-3-yl(oxolan-3-yl)methanol.
What is the SMILES notation for furan-3-yl(oxolan-3-yl)methanol?
The canonical SMILES for furan-3-yl(oxolan-3-yl)methanol is OC(c1ccoc1)C1CCOC1.
What is the InChIKey of furan-3-yl(oxolan-3-yl)methanol?
The InChIKey is BIJLTANTOKFODR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12O3/c10-9(7-1-3-11-5-7)8-2-4-12-6-8/h1,3,5,8-10H,2,4,6H2.
What are the key properties of furan-3-yl(oxolan-3-yl)methanol?
furan-3-yl(oxolan-3-yl)methanol has a molecular weight of 168.19 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl(oxolan-3-yl)methanol is sourced from PubChem (CID 63894971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).