(1R)-1-fluoro-4-methylcycloheptane

C8H15F — CID 155056751

IUPAC(1R)-1-fluoro-4-methylcycloheptane
SMILESCC1CCC[C@@H](F)CC1
InChIInChI=1S/C8H15F/c1-7-3-2-4-8(9)6-5-7/h7-8H,2-6H2,1H3/t7?,8-/m1/s1
InChIKeyVSHIBAAZGCSQKB-BRFYHDHCSA-N
MW130.21 g/mol
LogP2.92
Rot. Bonds

About (1R)-1-fluoro-4-methylcycloheptane

(1R)-1-fluoro-4-methylcycloheptane (PubChem CID 155056751) has the molecular formula C8H15F and a molecular weight of 130.21 g/mol. Its IUPAC name is (1R)-1-fluoro-4-methylcycloheptane.

Molecular Properties

Compound Name(1R)-1-fluoro-4-methylcycloheptane
PubChem CID155056751
Molecular FormulaC8H15F
Molecular Weight130.21 g/mol
Exact Mass130.12
IUPAC Name(1R)-1-fluoro-4-methylcycloheptane
SMILESCC1CCC[C@@H](F)CC1
InChIInChI=1S/C8H15F/c1-7-3-2-4-8(9)6-5-7/h7-8H,2-6H2,1H3/t7?,8-/m1/s1
InChIKeyVSHIBAAZGCSQKB-BRFYHDHCSA-N
XLogP2.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.21
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(4-fluorocyclohexyl)-4-methylcycloheptane
CID 142144551
1,5,9,13,17,21-hexamethylcyclotetracosane
CID 164675975
methylcyclobutane;tetrakis(methylcyclopentane)
CID 160836928
1-fluoro-3-[4-(4-methylcyclohexyl)cyclohexyl]cyclohexane
CID 126548134
1,4-dimethylcycloheptane;1,4-dimethylcyclohexane;methane;methylcyclohexane
CID 161210516
methylcyclopentane
CID 7296
cyclooctane;methylcyclobutane
CID 159456217
cyclobutane;cyclopropane;methylcyclobutane
CID 157419563
(1R)-1-fluoro-3-methylcyclopentane
CID 126671048
(4-fluorocyclohexyl)-(4-methylcyclohexyl)methanol
CID 123819677
methane;methylcyclobutane;methylcyclohexane;methylcyclopentane
CID 159112389
fluorocyclopentane;hydron
CID 175538452

Frequently Asked Questions

What is the IUPAC name of (1R)-1-fluoro-4-methylcycloheptane?
The IUPAC name of (1R)-1-fluoro-4-methylcycloheptane (CID 155056751) is (1R)-1-fluoro-4-methylcycloheptane.
What is the SMILES notation for (1R)-1-fluoro-4-methylcycloheptane?
The canonical SMILES for (1R)-1-fluoro-4-methylcycloheptane is CC1CCC[C@@H](F)CC1.
What is the InChIKey of (1R)-1-fluoro-4-methylcycloheptane?
The InChIKey is VSHIBAAZGCSQKB-BRFYHDHCSA-N. The full InChI is InChI=1S/C8H15F/c1-7-3-2-4-8(9)6-5-7/h7-8H,2-6H2,1H3/t7?,8-/m1/s1.
What are the key properties of (1R)-1-fluoro-4-methylcycloheptane?
(1R)-1-fluoro-4-methylcycloheptane has a molecular weight of 130.21 g/mol, XLogP of 2.92, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-fluoro-4-methylcycloheptane is sourced from PubChem (CID 155056751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).