(1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane

C2ClF4I — CID 95169758

IUPAC(1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane
SMILESFC(F)(F)[C@](F)(Cl)I
InChIInChI=1S/C2ClF4I/c3-1(4,8)2(5,6)7/t1-/m1/s1
InChIKeyDZIPETVAKXQJPX-PVQJCKRUSA-N
MW262.37 g/mol
LogP2.85
Rot. Bonds

About (1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane

(1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane (PubChem CID 95169758) has the molecular formula C2ClF4I and a molecular weight of 262.37 g/mol. Its IUPAC name is (1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane.

Molecular Properties

Compound Name(1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane
PubChem CID95169758
Molecular FormulaC2ClF4I
Molecular Weight262.37 g/mol
Exact Mass261.87
IUPAC Name(1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane
SMILESFC(F)(F)[C@](F)(Cl)I
InChIInChI=1S/C2ClF4I/c3-1(4,8)2(5,6)7/t1-/m1/s1
InChIKeyDZIPETVAKXQJPX-PVQJCKRUSA-N
XLogP2.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,1,1-trichloro-2,2,2-trifluoroethane
CID 9635
dichloro(difluoro)methane;1,1-dichloro-1,2,2,2-tetrafluoroethane
CID 87764597
1-chloro-1,1-difluoroethane;hydrate
CID 22410972
2,3-dichloro-1,1,1,4,4,4-hexafluoro-2,3-bis(trifluoromethyl)butane
CID 154106532
1-chloro-1,1,2,2,3,3,4,4-octafluoro-4-iodobutane
CID 11046660
1-chloro-1,1,2,2,2-pentafluoroethane;ethane
CID 141108517
1,1-dichloro-1,2,2,2-tetrafluoroethane;1,2-dichloro-1,1,2,2-tetrafluoroethane
CID 76970302
trifluoro(iodo)methane;zinc
CID 88708055
1,2-dichloro-1,1,2,2-tetrafluoroethane
CID 6429
chloro(trifluoro)methane;hydrofluoride
CID 158114823
trichloro(fluoro)methane;hydrochloride
CID 88794151
1-chloro-1,1,2,2,3,3,4,4,5,5,6,6-dodecafluoro-6-iodohexane
CID 2736614

Frequently Asked Questions

What is the IUPAC name of (1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane?
The IUPAC name of (1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane (CID 95169758) is (1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane.
What is the SMILES notation for (1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane?
The canonical SMILES for (1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane is FC(F)(F)[C@](F)(Cl)I.
What is the InChIKey of (1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane?
The InChIKey is DZIPETVAKXQJPX-PVQJCKRUSA-N. The full InChI is InChI=1S/C2ClF4I/c3-1(4,8)2(5,6)7/t1-/m1/s1.
What are the key properties of (1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane?
(1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane has a molecular weight of 262.37 g/mol, XLogP of 2.85, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-chloro-1,2,2,2-tetrafluoro-1-iodoethane is sourced from PubChem (CID 95169758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).