cis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane

C3Cl2F4 — CID 23235221

IUPACcis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane
SMILESFC1(F)[C@](F)(Cl)[C@]1(F)Cl
InChIInChI=1S/C3Cl2F4/c4-1(6)2(5,7)3(1,8)9/t1-,2+
InChIKeyWORCSMLDSVYWTB-XIXRPRMCSA-N
MW182.93 g/mol
LogP2.44
Rot. Bonds

About cis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane

cis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane (PubChem CID 23235221) has the molecular formula C3Cl2F4 and a molecular weight of 182.93 g/mol. Its IUPAC name is cis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane.

Molecular Properties

Compound Namecis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane
PubChem CID23235221
Molecular FormulaC3Cl2F4
Molecular Weight182.93 g/mol
Exact Mass181.93
IUPAC Namecis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane
SMILESFC1(F)[C@](F)(Cl)[C@]1(F)Cl
InChIInChI=1S/C3Cl2F4/c4-1(6)2(5,7)3(1,8)9/t1-,2+
InChIKeyWORCSMLDSVYWTB-XIXRPRMCSA-N
XLogP2.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.93
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane?
The IUPAC name of cis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane (CID 23235221) is cis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane.
What is the SMILES notation for cis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane?
The canonical SMILES for cis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane is FC1(F)[C@](F)(Cl)[C@]1(F)Cl.
What is the InChIKey of cis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane?
The InChIKey is WORCSMLDSVYWTB-XIXRPRMCSA-N. The full InChI is InChI=1S/C3Cl2F4/c4-1(6)2(5,7)3(1,8)9/t1-,2+.
What are the key properties of cis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane?
cis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane has a molecular weight of 182.93 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-1,2-dichloro-1,2,3,3-tetrafluorocyclopropane is sourced from PubChem (CID 23235221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).