difluoromethane;1,1,1,2,2-pentafluoroethane

C3H3F7 — CID 21183374

IUPACdifluoromethane;1,1,1,2,2-pentafluoroethane
SMILESFC(F)C(F)(F)F.FCF
InChIInChI=1S/C2HF5.CH2F2/c3-1(4)2(5,6)7;2-1-3/h1H;1H2
InChIKeyADYMJWSPQWGSOD-UHFFFAOYSA-N
MW172.04 g/mol
LogP2.70
Rot. Bonds

About difluoromethane;1,1,1,2,2-pentafluoroethane

difluoromethane;1,1,1,2,2-pentafluoroethane (PubChem CID 21183374) has the molecular formula C3H3F7 and a molecular weight of 172.04 g/mol. Its IUPAC name is difluoromethane;1,1,1,2,2-pentafluoroethane.

Molecular Properties

Compound Namedifluoromethane;1,1,1,2,2-pentafluoroethane
PubChem CID21183374
Molecular FormulaC3H3F7
Molecular Weight172.04 g/mol
Exact Mass172.01
IUPAC Namedifluoromethane;1,1,1,2,2-pentafluoroethane
SMILESFC(F)C(F)(F)F.FCF
InChIInChI=1S/C2HF5.CH2F2/c3-1(4)2(5,6)7;2-1-3/h1H;1H2
InChIKeyADYMJWSPQWGSOD-UHFFFAOYSA-N
XLogP2.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.04
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of difluoromethane;1,1,1,2,2-pentafluoroethane?
The IUPAC name of difluoromethane;1,1,1,2,2-pentafluoroethane (CID 21183374) is difluoromethane;1,1,1,2,2-pentafluoroethane.
What is the SMILES notation for difluoromethane;1,1,1,2,2-pentafluoroethane?
The canonical SMILES for difluoromethane;1,1,1,2,2-pentafluoroethane is FC(F)C(F)(F)F.FCF.
What is the InChIKey of difluoromethane;1,1,1,2,2-pentafluoroethane?
The InChIKey is ADYMJWSPQWGSOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C2HF5.CH2F2/c3-1(4)2(5,6)7;2-1-3/h1H;1H2.
What are the key properties of difluoromethane;1,1,1,2,2-pentafluoroethane?
difluoromethane;1,1,1,2,2-pentafluoroethane has a molecular weight of 172.04 g/mol, XLogP of 2.70, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for difluoromethane;1,1,1,2,2-pentafluoroethane is sourced from PubChem (CID 21183374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).