(2R)-1,1-difluoro-2-octylcyclopropane

C11H20F2 — CID 122227717

IUPAC(2R)-1,1-difluoro-2-octylcyclopropane
SMILESCCCCCCCC[C@@H]1CC1(F)F
InChIInChI=1S/C11H20F2/c1-2-3-4-5-6-7-8-10-9-11(10,12)13/h10H,2-9H2,1H3/t10-/m1/s1
InChIKeyRLYYQIORXCZRMJ-SNVBAGLBSA-N
MW190.28 g/mol
LogP4.39
Rot. Bonds7

About (2R)-1,1-difluoro-2-octylcyclopropane

(2R)-1,1-difluoro-2-octylcyclopropane (PubChem CID 122227717) has the molecular formula C11H20F2 and a molecular weight of 190.28 g/mol. Its IUPAC name is (2R)-1,1-difluoro-2-octylcyclopropane.

Molecular Properties

Compound Name(2R)-1,1-difluoro-2-octylcyclopropane
PubChem CID122227717
Molecular FormulaC11H20F2
Molecular Weight190.28 g/mol
Exact Mass190.15
IUPAC Name(2R)-1,1-difluoro-2-octylcyclopropane
SMILESCCCCCCCC[C@@H]1CC1(F)F
InChIInChI=1S/C11H20F2/c1-2-3-4-5-6-7-8-10-9-11(10,12)13/h10H,2-9H2,1H3/t10-/m1/s1
InChIKeyRLYYQIORXCZRMJ-SNVBAGLBSA-N
XLogP4.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.28
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1,1-dimethyl-2-octylcyclopropane
CID 15329257
1,1-dibromo-2-octylcyclopropane
CID 2780238
1,1-dichloro-2-octylcyclopropane
CID 10799099
1-methyl-2-pentylcyclopropan-1-ol
CID 15701982
1,1-difluoro-2-(2-hexyloctyl)cyclopropane
CID 130473775
3-[(1R)-2,2-difluorocyclopropyl]propan-1-ol
CID 129407915
cis-(1S,2S)-1,2-dihexylcyclopropan-1-ol
CID 14921306
3-(2,2-difluorocyclopropyl)propyl-methylazanium
CID 167468570
5-decyl-1-methylidene-1-silaspiro[2.2]pentane
CID 169011665
2,6-dihexylspiro[3.3]heptane
CID 58679549
(2R)-2-ethyl-1,1-difluorocyclopropane
CID 123881327
cis-(1R,2S)-1-ethoxy-2-hexylcyclopropan-1-ol
CID 102019528

Frequently Asked Questions

What is the IUPAC name of (2R)-1,1-difluoro-2-octylcyclopropane?
The IUPAC name of (2R)-1,1-difluoro-2-octylcyclopropane (CID 122227717) is (2R)-1,1-difluoro-2-octylcyclopropane.
What is the SMILES notation for (2R)-1,1-difluoro-2-octylcyclopropane?
The canonical SMILES for (2R)-1,1-difluoro-2-octylcyclopropane is CCCCCCCC[C@@H]1CC1(F)F.
What is the InChIKey of (2R)-1,1-difluoro-2-octylcyclopropane?
The InChIKey is RLYYQIORXCZRMJ-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H20F2/c1-2-3-4-5-6-7-8-10-9-11(10,12)13/h10H,2-9H2,1H3/t10-/m1/s1.
What are the key properties of (2R)-1,1-difluoro-2-octylcyclopropane?
(2R)-1,1-difluoro-2-octylcyclopropane has a molecular weight of 190.28 g/mol, XLogP of 4.39, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1,1-difluoro-2-octylcyclopropane is sourced from PubChem (CID 122227717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).