trans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane

C5H8F2 — CID 12673209

IUPACtrans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane
SMILESC[C@@H]1[C@@H](C)C1(F)F
InChIInChI=1S/C5H8F2/c1-3-4(2)5(3,6)7/h3-4H,1-2H3/t3-,4-/m1/s1
InChIKeyQACKABMXGDZLJE-QWWZWVQMSA-N
MW106.11 g/mol
LogP1.91
Rot. Bonds

About trans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane

trans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane (PubChem CID 12673209) has the molecular formula C5H8F2 and a molecular weight of 106.11 g/mol. Its IUPAC name is trans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane.

Molecular Properties

Compound Nametrans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane
PubChem CID12673209
Molecular FormulaC5H8F2
Molecular Weight106.11 g/mol
Exact Mass106.06
IUPAC Nametrans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane
SMILESC[C@@H]1[C@@H](C)C1(F)F
InChIInChI=1S/C5H8F2/c1-3-4(2)5(3,6)7/h3-4H,1-2H3/t3-,4-/m1/s1
InChIKeyQACKABMXGDZLJE-QWWZWVQMSA-N
XLogP1.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.11
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-Methyl-2-pentylidene difluoride
CID 21733020
1,1-Difluoro-2,2-dimethyl-cyclopropane
CID 560918
1,1-Difluoro-2,3-dimethyl-cyclopropane
CID 561609
Dimethylfluorocyclopropane
CID 18520884
1,1-Difluoro-2-methyl-3-ethyl cyclopropane
CID 561656
(2R,3S)-1,1-Difluoro-2,3-dimethylcyclopropane
CID 12673208
2,2-Difluoroethylcyclopropane
CID 18520892
1,1-Difluoroethylcyclopropane
CID 18520897
1,1,2-Trifluoroethylcyclopropane
CID 18520917
1-Fluoroethylcyclopropane
CID 22262429
1,2,2-Trifluoro-4-methylpentane
CID 153850854
1-(Difluoromethyl)-1-fluoro-2-methylcyclopropane
CID 12584496

Frequently Asked Questions

What is the IUPAC name of trans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane?
The IUPAC name of trans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane (CID 12673209) is trans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane.
What is the SMILES notation for trans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane?
The canonical SMILES for trans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane is C[C@@H]1[C@@H](C)C1(F)F.
What is the InChIKey of trans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane?
The InChIKey is QACKABMXGDZLJE-QWWZWVQMSA-N. The full InChI is InChI=1S/C5H8F2/c1-3-4(2)5(3,6)7/h3-4H,1-2H3/t3-,4-/m1/s1.
What are the key properties of trans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane?
trans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane has a molecular weight of 106.11 g/mol, XLogP of 1.91, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(2R,3R)-1,1-difluoro-2,3-dimethylcyclopropane is sourced from PubChem (CID 12673209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).