1-(fluoromethoxy)-4-propylcyclohexane

C10H19FO — CID 20750924

IUPAC1-(fluoromethoxy)-4-propylcyclohexane
SMILESCCCC1CCC(OCF)CC1
InChIInChI=1S/C10H19FO/c1-2-3-9-4-6-10(7-5-9)12-8-11/h9-10H,2-8H2,1H3
InChIKeyBDAPQQUQQGBJOV-UHFFFAOYSA-N
MW174.26 g/mol
LogP3.29
Rot. Bonds4

About 1-(fluoromethoxy)-4-propylcyclohexane

1-(fluoromethoxy)-4-propylcyclohexane (PubChem CID 20750924) has the molecular formula C10H19FO and a molecular weight of 174.26 g/mol. Its IUPAC name is 1-(fluoromethoxy)-4-propylcyclohexane.

Molecular Properties

Compound Name1-(fluoromethoxy)-4-propylcyclohexane
PubChem CID20750924
Molecular FormulaC10H19FO
Molecular Weight174.26 g/mol
Exact Mass174.14
IUPAC Name1-(fluoromethoxy)-4-propylcyclohexane
SMILESCCCC1CCC(OCF)CC1
InChIInChI=1S/C10H19FO/c1-2-3-9-4-6-10(7-5-9)12-8-11/h9-10H,2-8H2,1H3
InChIKeyBDAPQQUQQGBJOV-UHFFFAOYSA-N
XLogP3.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.26
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-Methoxy-4-methylcyclohexane
CID 6336264
1-Methoxy-4-(propan-2-yl)cyclohexane
CID 23594959
1-Methoxy-2-methylcyclohexane
CID 12546406
Cyclohexane, (1-methoxyethyl)-
CID 106834
(2R,4S)-2-cyclohexyl-4-fluorooxane
CID 146168810
cis1Methoxy 2methyl cyclohexane
CID 11137184
1,2-Dimethoxyethylcyclohexane
CID 23183239
1-Methoxy-3-pentylcyclohexane
CID 101551563
(2-Methoxyethyl)cyclohexane
CID 557611
(2S,4R)-2-cyclohexyl-4-fluorooxane
CID 11745349
2-Cyclohexyl-4-fluorooxolane
CID 12038085
(2R,6S)-4-fluoro-2,6-di(propan-2-yl)oxane
CID 14492060

Frequently Asked Questions

What is the IUPAC name of 1-(fluoromethoxy)-4-propylcyclohexane?
The IUPAC name of 1-(fluoromethoxy)-4-propylcyclohexane (CID 20750924) is 1-(fluoromethoxy)-4-propylcyclohexane.
What is the SMILES notation for 1-(fluoromethoxy)-4-propylcyclohexane?
The canonical SMILES for 1-(fluoromethoxy)-4-propylcyclohexane is CCCC1CCC(OCF)CC1.
What is the InChIKey of 1-(fluoromethoxy)-4-propylcyclohexane?
The InChIKey is BDAPQQUQQGBJOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FO/c1-2-3-9-4-6-10(7-5-9)12-8-11/h9-10H,2-8H2,1H3.
What are the key properties of 1-(fluoromethoxy)-4-propylcyclohexane?
1-(fluoromethoxy)-4-propylcyclohexane has a molecular weight of 174.26 g/mol, XLogP of 3.29, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(fluoromethoxy)-4-propylcyclohexane is sourced from PubChem (CID 20750924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).