(2S)-2-(furan-2-yl)hexan-1-ol

C10H16O2 — CID 134866929

IUPAC(2S)-2-(furan-2-yl)hexan-1-ol
SMILESCCCC[C@@H](CO)c1ccco1
InChIInChI=1S/C10H16O2/c1-2-3-5-9(8-11)10-6-4-7-12-10/h4,6-7,9,11H,2-3,5,8H2,1H3/t9-/m0/s1
InChIKeyDIFKAPOHLIIWDD-VIFPVBQESA-N
MW168.24 g/mol
LogP2.55
Rot. Bonds5

About (2S)-2-(furan-2-yl)hexan-1-ol

(2S)-2-(furan-2-yl)hexan-1-ol (PubChem CID 134866929) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is (2S)-2-(furan-2-yl)hexan-1-ol.

Molecular Properties

Compound Name(2S)-2-(furan-2-yl)hexan-1-ol
PubChem CID134866929
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name(2S)-2-(furan-2-yl)hexan-1-ol
SMILESCCCC[C@@H](CO)c1ccco1
InChIInChI=1S/C10H16O2/c1-2-3-5-9(8-11)10-6-4-7-12-10/h4,6-7,9,11H,2-3,5,8H2,1H3/t9-/m0/s1
InChIKeyDIFKAPOHLIIWDD-VIFPVBQESA-N
XLogP2.55
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-Ipomeanol
CID 36284
2-Pentylfuran
CID 19602
2-Butylfuran
CID 20534
2-Heptylfuran
CID 19603
Furfuryl methyl ketone
CID 228583
Avocadenofuran
CID 6857792
4-(2-Furyl)-2-butanone
CID 12780
Isoamyl 3-(2-furan)propionate
CID 538506
3-(5-Methyl-2-furyl)butanal
CID 3578033
2-Decylfuran
CID 12762300
2-Octylfuran
CID 77845
3-Methyl-2-(3-methylbut-2-enyl)-furan
CID 84825

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(furan-2-yl)hexan-1-ol?
The IUPAC name of (2S)-2-(furan-2-yl)hexan-1-ol (CID 134866929) is (2S)-2-(furan-2-yl)hexan-1-ol.
What is the SMILES notation for (2S)-2-(furan-2-yl)hexan-1-ol?
The canonical SMILES for (2S)-2-(furan-2-yl)hexan-1-ol is CCCC[C@@H](CO)c1ccco1.
What is the InChIKey of (2S)-2-(furan-2-yl)hexan-1-ol?
The InChIKey is DIFKAPOHLIIWDD-VIFPVBQESA-N. The full InChI is InChI=1S/C10H16O2/c1-2-3-5-9(8-11)10-6-4-7-12-10/h4,6-7,9,11H,2-3,5,8H2,1H3/t9-/m0/s1.
What are the key properties of (2S)-2-(furan-2-yl)hexan-1-ol?
(2S)-2-(furan-2-yl)hexan-1-ol has a molecular weight of 168.24 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(furan-2-yl)hexan-1-ol is sourced from PubChem (CID 134866929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).