(2,5-dimethylfuran-3-yl)methanol

C7H10O2 — CID 10396847

IUPAC(2,5-dimethylfuran-3-yl)methanol
SMILESCc1cc(CO)c(C)o1
InChIInChI=1S/C7H10O2/c1-5-3-7(4-8)6(2)9-5/h3,8H,4H2,1-2H3
InChIKeyYZKVNZQOYBRCPL-UHFFFAOYSA-N
MW126.15 g/mol
LogP1.39
Rot. Bonds1

About (2,5-dimethylfuran-3-yl)methanol

(2,5-dimethylfuran-3-yl)methanol (PubChem CID 10396847) has the molecular formula C7H10O2 and a molecular weight of 126.15 g/mol. Its IUPAC name is (2,5-dimethylfuran-3-yl)methanol.

Molecular Properties

Compound Name(2,5-dimethylfuran-3-yl)methanol
PubChem CID10396847
Molecular FormulaC7H10O2
Molecular Weight126.15 g/mol
Exact Mass126.07
IUPAC Name(2,5-dimethylfuran-3-yl)methanol
SMILESCc1cc(CO)c(C)o1
InChIInChI=1S/C7H10O2/c1-5-3-7(4-8)6(2)9-5/h3,8H,4H2,1-2H3
InChIKeyYZKVNZQOYBRCPL-UHFFFAOYSA-N
XLogP1.39
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.15
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(hydroxymethyl)-5-methylfuran-3-yl]methanol
CID 66616345
[5-(aminomethyl)-2-methylfuran-3-yl]methanol
CID 82502468
2-[(2,5-dimethylfuran-3-yl)methylamino]propane-1,3-diol
CID 115876595
1-(2,5-dimethylfuran-3-yl)-N-methylmethanamine
CID 43163687
(2S)-2-[(2,5-dimethylfuran-3-yl)methylamino]propan-1-ol
CID 103880707
[2-methyl-5-(4-methylphenyl)furan-3-yl]methanol
CID 23074335
3-(2,5-dimethylfuran-3-yl)propanoic acid
CID 59859508
2,5-dimethyl-3-pentylfuran
CID 15522203
4-(hydroxymethyl)-5-methylfuran-2-carbohydrazide
CID 63576410
3-[3-[3-(2,5-dimethylfuran-3-yl)propylsulfanyl]propyl]-2,5-dimethylfuran
CID 21429347
3-(2-isocyanoethyl)-2,5-dimethylfuran
CID 83479425
[5-(4-chlorophenyl)-2-methylfuran-3-yl]methanol
CID 7245332

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethylfuran-3-yl)methanol?
The IUPAC name of (2,5-dimethylfuran-3-yl)methanol (CID 10396847) is (2,5-dimethylfuran-3-yl)methanol.
What is the SMILES notation for (2,5-dimethylfuran-3-yl)methanol?
The canonical SMILES for (2,5-dimethylfuran-3-yl)methanol is Cc1cc(CO)c(C)o1.
What is the InChIKey of (2,5-dimethylfuran-3-yl)methanol?
The InChIKey is YZKVNZQOYBRCPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O2/c1-5-3-7(4-8)6(2)9-5/h3,8H,4H2,1-2H3.
What are the key properties of (2,5-dimethylfuran-3-yl)methanol?
(2,5-dimethylfuran-3-yl)methanol has a molecular weight of 126.15 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylfuran-3-yl)methanol is sourced from PubChem (CID 10396847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).