fluoroform;1,3-oxazole

C4H4F3NO — CID 161115791

IUPACfluoroform;1,3-oxazole
SMILESFC(F)F.c1cocn1
InChIInChI=1S/C3H3NO.CHF3/c1-2-5-3-4-1;2-1(3)4/h1-3H;1H
InChIKeyUKHKYZCLXRJZHA-UHFFFAOYSA-N
MW139.08 g/mol
LogP1.85
Rot. Bonds

About fluoroform;1,3-oxazole

fluoroform;1,3-oxazole (PubChem CID 161115791) has the molecular formula C4H4F3NO and a molecular weight of 139.08 g/mol. Its IUPAC name is fluoroform;1,3-oxazole.

Molecular Properties

Compound Namefluoroform;1,3-oxazole
PubChem CID161115791
Molecular FormulaC4H4F3NO
Molecular Weight139.08 g/mol
Exact Mass139.02
IUPAC Namefluoroform;1,3-oxazole
SMILESFC(F)F.c1cocn1
InChIInChI=1S/C3H3NO.CHF3/c1-2-5-3-4-1;2-1(3)4/h1-3H;1H
InChIKeyUKHKYZCLXRJZHA-UHFFFAOYSA-N
XLogP1.85
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.08
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of fluoroform;1,3-oxazole?
The IUPAC name of fluoroform;1,3-oxazole (CID 161115791) is fluoroform;1,3-oxazole.
What is the SMILES notation for fluoroform;1,3-oxazole?
The canonical SMILES for fluoroform;1,3-oxazole is FC(F)F.c1cocn1.
What is the InChIKey of fluoroform;1,3-oxazole?
The InChIKey is UKHKYZCLXRJZHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3NO.CHF3/c1-2-5-3-4-1;2-1(3)4/h1-3H;1H.
What are the key properties of fluoroform;1,3-oxazole?
fluoroform;1,3-oxazole has a molecular weight of 139.08 g/mol, XLogP of 1.85, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoroform;1,3-oxazole is sourced from PubChem (CID 161115791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).