CID 101376859

C3HF2 — CID 101376859

IUPAC—
SMILES[C]#CC(F)F
InChIInChI=1S/C3HF2/c1-2-3(4)5/h3H
InChIKeyFYOADRWXIXHCRU-UHFFFAOYSA-N
MW75.04 g/mol
LogP0.84
Rot. Bonds

About CID 101376859

CID 101376859 (PubChem CID 101376859) has the molecular formula C3HF2 and a molecular weight of 75.04 g/mol.

Molecular Properties

Compound NameCID 101376859
PubChem CID101376859
Molecular FormulaC3HF2
Molecular Weight75.04 g/mol
Exact Mass75.00
IUPAC Name—
SMILES[C]#CC(F)F
InChIInChI=1S/C3HF2/c1-2-3(4)5/h3H
InChIKeyFYOADRWXIXHCRU-UHFFFAOYSA-N
XLogP0.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50075.04
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 101376859?
The IUPAC name of CID 101376859 (CID 101376859) is not available.
What is the SMILES notation for CID 101376859?
The canonical SMILES for CID 101376859 is [C]#CC(F)F.
What is the InChIKey of CID 101376859?
The InChIKey is FYOADRWXIXHCRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3HF2/c1-2-3(4)5/h3H.
What are the key properties of CID 101376859?
CID 101376859 has a molecular weight of 75.04 g/mol, XLogP of 0.84, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 101376859 is sourced from PubChem (CID 101376859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).