CID 146166522

C4H6F3 — CID 146166522

IUPAC—
SMILESC[C](C)C(F)(F)F
InChIInChI=1S/C4H6F3/c1-3(2)4(5,6)7/h1-2H3
InChIKeyQURQUJJQJWZBEO-UHFFFAOYSA-N
MW111.09 g/mol
LogP2.16
Rot. Bonds

About CID 146166522

CID 146166522 (PubChem CID 146166522) has the molecular formula C4H6F3 and a molecular weight of 111.09 g/mol.

Molecular Properties

Compound NameCID 146166522
PubChem CID146166522
Molecular FormulaC4H6F3
Molecular Weight111.09 g/mol
Exact Mass111.04
IUPAC Name—
SMILESC[C](C)C(F)(F)F
InChIInChI=1S/C4H6F3/c1-3(2)4(5,6)7/h1-2H3
InChIKeyQURQUJJQJWZBEO-UHFFFAOYSA-N
XLogP2.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.09
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,1,1,3,3-Pentafluorobutane
CID 67884
2,2-Difluorobutane
CID 520729
1,1,1-Trifluorobutane
CID 14512801
1,1,1,2,2-Pentafluorobutane
CID 19980372
1,1,1,3,3,3-Hexafluoro-2-methylpropane
CID 2778258
1,1,1-Trifluoro-2,2-dimethylpropane
CID 12025748
Fluoro-t-butyl fluoride
CID 12756878
2-Methylpropylidene difluoride
CID 18506758
Butane, 1,1-difluoro-
CID 18967886
1,1,1,2,3,3,3-Heptafluoro-2-methylpropane
CID 12025746
1,1,1,2,3,3-Hexafluorobutane
CID 15576966
1,1,1,2,2,3-Hexafluorobutane
CID 12980435

Frequently Asked Questions

What is the IUPAC name of CID 146166522?
The IUPAC name of CID 146166522 (CID 146166522) is not available.
What is the SMILES notation for CID 146166522?
The canonical SMILES for CID 146166522 is C[C](C)C(F)(F)F.
What is the InChIKey of CID 146166522?
The InChIKey is QURQUJJQJWZBEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6F3/c1-3(2)4(5,6)7/h1-2H3.
What are the key properties of CID 146166522?
CID 146166522 has a molecular weight of 111.09 g/mol, XLogP of 2.16, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 146166522 is sourced from PubChem (CID 146166522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).