2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride

C3H4ClF5 — CID 160580359

IUPAC2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride
SMILESCC(F)(Cl)C(F)(F)F.F
InChIInChI=1S/C3H3ClF4.FH/c1-2(4,5)3(6,7)8;/h1H3;1H
InChIKeyRBRVTNSFFNGURU-UHFFFAOYSA-N
MW170.51 g/mol
LogP2.63
Rot. Bonds

About 2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride

2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride (PubChem CID 160580359) has the molecular formula C3H4ClF5 and a molecular weight of 170.51 g/mol. Its IUPAC name is 2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride.

Molecular Properties

Compound Name2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride
PubChem CID160580359
Molecular FormulaC3H4ClF5
Molecular Weight170.51 g/mol
Exact Mass169.99
IUPAC Name2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride
SMILESCC(F)(Cl)C(F)(F)F.F
InChIInChI=1S/C3H3ClF4.FH/c1-2(4,5)3(6,7)8;/h1H3;1H
InChIKeyRBRVTNSFFNGURU-UHFFFAOYSA-N
XLogP2.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.51
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Propane, 2-chloro-1,1,1,2-tetrafluoro-
CID 20453893
Chlorodifluoropropane
CID 19812724
3-Chloro-1,1,1,3-tetrafluorobutane
CID 22027026
1-Chloro-1,1,2,2-tetrafluoropropane
CID 67903
2-Chloro-1,1,1,3-tetrafluoro-2-methylpropane
CID 14066892
2-Chloro-1,1,1,2,3,3-hexafluoropropane
CID 12829395
1,1,2,3,3-Pentafluoro-2-chloropropane
CID 15829170
1-Chloro-1,1-difluoroethane;hydrofluoride
CID 19042548
1-Chloro-1,1-difluoroethane;1,1,1-trifluoroethane
CID 19813942
1-Chloro-1,1-difluoroethane;1,1,1,2-tetrafluoroethane
CID 19893168
3-Chloro-1,1,2,3-tetrafluorobutane
CID 21459244
2-Chloro-1,1,1,3,3-pentafluoro-2-methylpropane
CID 21459264

Frequently Asked Questions

What is the IUPAC name of 2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride?
The IUPAC name of 2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride (CID 160580359) is 2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride.
What is the SMILES notation for 2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride?
The canonical SMILES for 2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride is CC(F)(Cl)C(F)(F)F.F.
What is the InChIKey of 2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride?
The InChIKey is RBRVTNSFFNGURU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3ClF4.FH/c1-2(4,5)3(6,7)8;/h1H3;1H.
What are the key properties of 2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride?
2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride has a molecular weight of 170.51 g/mol, XLogP of 2.63, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-1,1,1,2-tetrafluoropropane;hydrofluoride is sourced from PubChem (CID 160580359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).