1-(furan-2-yl)propan-2-ol

C7H10O2 — CID 10855456

IUPAC1-(furan-2-yl)propan-2-ol
SMILESCC(O)Cc1ccco1
InChIInChI=1S/C7H10O2/c1-6(8)5-7-3-2-4-9-7/h2-4,6,8H,5H2,1H3
InChIKeyPGFZSINXOZLDPL-UHFFFAOYSA-N
MW126.15 g/mol
LogP1.20
Rot. Bonds2

About 1-(furan-2-yl)propan-2-ol

1-(furan-2-yl)propan-2-ol (PubChem CID 10855456) has the molecular formula C7H10O2 and a molecular weight of 126.15 g/mol. Its IUPAC name is 1-(furan-2-yl)propan-2-ol.

Molecular Properties

Compound Name1-(furan-2-yl)propan-2-ol
PubChem CID10855456
Molecular FormulaC7H10O2
Molecular Weight126.15 g/mol
Exact Mass126.07
IUPAC Name1-(furan-2-yl)propan-2-ol
SMILESCC(O)Cc1ccco1
InChIInChI=1S/C7H10O2/c1-6(8)5-7-3-2-4-9-7/h2-4,6,8H,5H2,1H3
InChIKeyPGFZSINXOZLDPL-UHFFFAOYSA-N
XLogP1.20
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.15
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)propan-2-ol?
The IUPAC name of 1-(furan-2-yl)propan-2-ol (CID 10855456) is 1-(furan-2-yl)propan-2-ol.
What is the SMILES notation for 1-(furan-2-yl)propan-2-ol?
The canonical SMILES for 1-(furan-2-yl)propan-2-ol is CC(O)Cc1ccco1.
What is the InChIKey of 1-(furan-2-yl)propan-2-ol?
The InChIKey is PGFZSINXOZLDPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O2/c1-6(8)5-7-3-2-4-9-7/h2-4,6,8H,5H2,1H3.
What are the key properties of 1-(furan-2-yl)propan-2-ol?
1-(furan-2-yl)propan-2-ol has a molecular weight of 126.15 g/mol, XLogP of 1.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)propan-2-ol is sourced from PubChem (CID 10855456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).