furan-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol

C11H14O5 — CID 174941274

IUPACfuran-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol
SMILESOCc1ccc(CO)o1.OCc1ccco1
InChIInChI=1S/C6H8O3.C5H6O2/c7-3-5-1-2-6(4-8)9-5;6-4-5-2-1-3-7-5/h1-2,7-8H,3-4H2;1-3,6H,4H2
InChIKeyMKZZSZGVNGAZHQ-UHFFFAOYSA-N
MW226.23 g/mol
LogP1.04
Rot. Bonds3

About furan-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol

furan-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol (PubChem CID 174941274) has the molecular formula C11H14O5 and a molecular weight of 226.23 g/mol. Its IUPAC name is furan-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol.

Molecular Properties

Compound Namefuran-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol
PubChem CID174941274
Molecular FormulaC11H14O5
Molecular Weight226.23 g/mol
Exact Mass226.08
IUPAC Namefuran-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol
SMILESOCc1ccc(CO)o1.OCc1ccco1
InChIInChI=1S/C6H8O3.C5H6O2/c7-3-5-1-2-6(4-8)9-5;6-4-5-2-1-3-7-5/h1-2,7-8H,3-4H2;1-3,6H,4H2
InChIKeyMKZZSZGVNGAZHQ-UHFFFAOYSA-N
XLogP1.04
TPSA86.97 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.23
LogP ≤ 51.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

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furan-2-ylmethanol;2-methylfuran
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furan-2-ylmethanol;2-propan-2-ylsulfanylpropane
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furan-2-ylmethanol;4-oxopentanoic acid
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(5-ethylfuran-2-yl)methanol;furan-2-carbaldehyde;furan-2-ylmethanol;5-(hydroxymethyl)furan-2-carbaldehyde;molecular hydrogen
CID 163692906
[5-[[furan-2-ylmethyl(thiophen-3-ylmethyl)amino]methyl]furan-2-yl]methanol
CID 46992645
azane;(5-methylfuran-2-yl)methanol
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furan-2-ylmethanethiol
CID 158949317
11-(furan-2-yl)undecan-1-ol
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CID 156698008

Frequently Asked Questions

What is the IUPAC name of furan-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol?
The IUPAC name of furan-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol (CID 174941274) is furan-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol.
What is the SMILES notation for furan-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol?
The canonical SMILES for furan-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol is OCc1ccc(CO)o1.OCc1ccco1.
What is the InChIKey of furan-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol?
The InChIKey is MKZZSZGVNGAZHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O3.C5H6O2/c7-3-5-1-2-6(4-8)9-5;6-4-5-2-1-3-7-5/h1-2,7-8H,3-4H2;1-3,6H,4H2.
What are the key properties of furan-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol?
furan-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol has a molecular weight of 226.23 g/mol, XLogP of 1.04, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-ylmethanol;[5-(hydroxymethyl)furan-2-yl]methanol is sourced from PubChem (CID 174941274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).