2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane

C10H16F2 — CID 72784750

IUPAC2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane
SMILESFC(F)CCC1CC2CCC1C2
InChIInChI=1S/C10H16F2/c11-10(12)4-3-9-6-7-1-2-8(9)5-7/h7-10H,1-6H2
InChIKeyFPODXVQWJTXVCH-UHFFFAOYSA-N
MW174.23 g/mol
LogP3.47
Rot. Bonds3

About 2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane

2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane (PubChem CID 72784750) has the molecular formula C10H16F2 and a molecular weight of 174.23 g/mol. Its IUPAC name is 2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane.

Molecular Properties

Compound Name2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane
PubChem CID72784750
Molecular FormulaC10H16F2
Molecular Weight174.23 g/mol
Exact Mass174.12
IUPAC Name2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane
SMILESFC(F)CCC1CC2CCC1C2
InChIInChI=1S/C10H16F2/c11-10(12)4-3-9-6-7-1-2-8(9)5-7/h7-10H,1-6H2
InChIKeyFPODXVQWJTXVCH-UHFFFAOYSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.23
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Norbornane, 2-isobutyl-
CID 565405
Bicyclo(2.2.1)heptane, 2-ethyl-
CID 137449
2,3-Dimethylbicyclo(2.2.1)heptane
CID 140711
2-Butylbicyclo[2.2.1]heptane
CID 565406
2-(Fluoromethyl)bicyclo[2.2.1]heptane
CID 13610084
2-(Trifluoromethyl)bicyclo[2.2.1]heptane
CID 21927729
2-(1,1,2,2,3,3,4,4,5,5,6,6,6-Tridecafluorohexyl)bicyclo[2.2.1]heptane
CID 89413784
Exo-2-ethylbicyclo[2.2.1]heptane
CID 12602366
(1R,2R,3S,4S)-2,3-dimethylbicyclo[2.2.1]heptane
CID 21675160
2,2-Difluoro-5-methylbicyclo[2.2.1]heptane
CID 45090371
2,2-Difluoro-6-methylbicyclo[2.2.1]heptane
CID 45090372
2-Iodo-3-(trifluoromethyl)bicyclo[2.2.1]heptane
CID 131857871

Frequently Asked Questions

What is the IUPAC name of 2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane?
The IUPAC name of 2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane (CID 72784750) is 2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane.
What is the SMILES notation for 2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane?
The canonical SMILES for 2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane is FC(F)CCC1CC2CCC1C2.
What is the InChIKey of 2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane?
The InChIKey is FPODXVQWJTXVCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F2/c11-10(12)4-3-9-6-7-1-2-8(9)5-7/h7-10H,1-6H2.
What are the key properties of 2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane?
2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane has a molecular weight of 174.23 g/mol, XLogP of 3.47, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3-difluoropropyl)bicyclo[2.2.1]heptane is sourced from PubChem (CID 72784750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).