3-fluoro-2-propyloxolane

C7H13FO — CID 156747497

IUPAC3-fluoro-2-propyloxolane
SMILESCCCC1OCCC1F
InChIInChI=1S/C7H13FO/c1-2-3-7-6(8)4-5-9-7/h6-7H,2-5H2,1H3
InChIKeyNAQJKSUWUANDIO-UHFFFAOYSA-N
MW132.18 g/mol
LogP1.91
Rot. Bonds2

About 3-fluoro-2-propyloxolane

3-fluoro-2-propyloxolane (PubChem CID 156747497) has the molecular formula C7H13FO and a molecular weight of 132.18 g/mol. Its IUPAC name is 3-fluoro-2-propyloxolane.

Molecular Properties

Compound Name3-fluoro-2-propyloxolane
PubChem CID156747497
Molecular FormulaC7H13FO
Molecular Weight132.18 g/mol
Exact Mass132.10
IUPAC Name3-fluoro-2-propyloxolane
SMILESCCCC1OCCC1F
InChIInChI=1S/C7H13FO/c1-2-3-7-6(8)4-5-9-7/h6-7H,2-5H2,1H3
InChIKeyNAQJKSUWUANDIO-UHFFFAOYSA-N
XLogP1.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.18
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-chloro-2-propyloxolane
CID 13494559
(2-propyloxolan-3-yl)methanamine
CID 79368036
(2R,3R)-2-(2-bromoethyl)-3-propyl-1,4-dioxane
CID 97304593
2-butyloxolan-3-amine
CID 79365227
(3-azido-4-fluorooxan-2-yl)methanol
CID 130004697
(1R,4aS,8aS)-6-fluoro-1-heptyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isochromene
CID 154716801
4-fluoro-5-propylazepane
CID 84650925
ethane;2-(2-propyl-1,3-dioxan-4-yl)ethanol
CID 145311557
(2S,3S)-2-ethyloxolan-3-amine
CID 124511863
(2R,3R)-3-fluorooxolan-2-ol
CID 98040547
3-(chloromethyl)-2-hexyloxolane
CID 79373695
2-pentyloxolane-3-carboxylic acid
CID 79368786

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-propyloxolane?
The IUPAC name of 3-fluoro-2-propyloxolane (CID 156747497) is 3-fluoro-2-propyloxolane.
What is the SMILES notation for 3-fluoro-2-propyloxolane?
The canonical SMILES for 3-fluoro-2-propyloxolane is CCCC1OCCC1F.
What is the InChIKey of 3-fluoro-2-propyloxolane?
The InChIKey is NAQJKSUWUANDIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13FO/c1-2-3-7-6(8)4-5-9-7/h6-7H,2-5H2,1H3.
What are the key properties of 3-fluoro-2-propyloxolane?
3-fluoro-2-propyloxolane has a molecular weight of 132.18 g/mol, XLogP of 1.91, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-propyloxolane is sourced from PubChem (CID 156747497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).