1,1,3-trifluoro-3-methylcyclopentane

C6H9F3 — CID 118604356

IUPAC1,1,3-trifluoro-3-methylcyclopentane
SMILESCC1(F)CCC(F)(F)C1
InChIInChI=1S/C6H9F3/c1-5(7)2-3-6(8,9)4-5/h2-4H2,1H3
InChIKeyDMEAIUPPKASWKD-UHFFFAOYSA-N
MW138.13 g/mol
LogP2.53
Rot. Bonds

About 1,1,3-trifluoro-3-methylcyclopentane

1,1,3-trifluoro-3-methylcyclopentane (PubChem CID 118604356) has the molecular formula C6H9F3 and a molecular weight of 138.13 g/mol. Its IUPAC name is 1,1,3-trifluoro-3-methylcyclopentane.

Molecular Properties

Compound Name1,1,3-trifluoro-3-methylcyclopentane
PubChem CID118604356
Molecular FormulaC6H9F3
Molecular Weight138.13 g/mol
Exact Mass138.07
IUPAC Name1,1,3-trifluoro-3-methylcyclopentane
SMILESCC1(F)CCC(F)(F)C1
InChIInChI=1S/C6H9F3/c1-5(7)2-3-6(8,9)4-5/h2-4H2,1H3
InChIKeyDMEAIUPPKASWKD-UHFFFAOYSA-N
XLogP2.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.13
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-fluoro-1-methylcyclopropane
CID 18684623
1,1-difluoro-4,4-dimethylcyclohexane;methane
CID 159801836
1,1-difluoro-4-iodo-4-methylcyclohexane
CID 118653860
ethane;4-fluoro-4-methylpiperidine
CID 142139578
1-(3,3-difluoro-1-methylcyclopentyl)-2-methylpropan-1-one
CID 177196687
1-fluoro-1-methylcycloheptane
CID 57055784
1,1-difluoro-4-methoxy-4-methylcyclohexane
CID 122579761
4,4-difluoro-2,2-dimethylcyclohexan-1-amine
CID 138987456
6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane
CID 156813146
3-fluoro-1,3-dimethylcyclobutan-1-ol
CID 58387782
cobalt;1,1-difluorocyclopropane
CID 143921033
6,6-difluorospiro[2.5]octane
CID 58561650

Frequently Asked Questions

What is the IUPAC name of 1,1,3-trifluoro-3-methylcyclopentane?
The IUPAC name of 1,1,3-trifluoro-3-methylcyclopentane (CID 118604356) is 1,1,3-trifluoro-3-methylcyclopentane.
What is the SMILES notation for 1,1,3-trifluoro-3-methylcyclopentane?
The canonical SMILES for 1,1,3-trifluoro-3-methylcyclopentane is CC1(F)CCC(F)(F)C1.
What is the InChIKey of 1,1,3-trifluoro-3-methylcyclopentane?
The InChIKey is DMEAIUPPKASWKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F3/c1-5(7)2-3-6(8,9)4-5/h2-4H2,1H3.
What are the key properties of 1,1,3-trifluoro-3-methylcyclopentane?
1,1,3-trifluoro-3-methylcyclopentane has a molecular weight of 138.13 g/mol, XLogP of 2.53, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3-trifluoro-3-methylcyclopentane is sourced from PubChem (CID 118604356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).