1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane

C9H13Cl2F2NO — CID 162217428

IUPAC1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane
SMILESC.C=C(F)Cl.O=C1CCCN1C=C(F)Cl
InChIInChI=1S/C6H7ClFNO.C2H2ClF.CH4/c7-5(8)4-9-3-1-2-6(9)10;1-2(3)4;/h4H,1-3H2;1H2;1H4
InChIKeyZTQUXAZVYOAMCJ-UHFFFAOYSA-N
MW260.11 g/mol
LogP3.92
Rot. Bonds1

About 1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane

1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane (PubChem CID 162217428) has the molecular formula C9H13Cl2F2NO and a molecular weight of 260.11 g/mol. Its IUPAC name is 1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane.

Molecular Properties

Compound Name1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane
PubChem CID162217428
Molecular FormulaC9H13Cl2F2NO
Molecular Weight260.11 g/mol
Exact Mass259.03
IUPAC Name1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane
SMILESC.C=C(F)Cl.O=C1CCCN1C=C(F)Cl
InChIInChI=1S/C6H7ClFNO.C2H2ClF.CH4/c7-5(8)4-9-3-1-2-6(9)10;1-2(3)4;/h4H,1-3H2;1H2;1H4
InChIKeyZTQUXAZVYOAMCJ-UHFFFAOYSA-N
XLogP3.92
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.11
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane?
The IUPAC name of 1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane (CID 162217428) is 1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane.
What is the SMILES notation for 1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane?
The canonical SMILES for 1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane is C.C=C(F)Cl.O=C1CCCN1C=C(F)Cl.
What is the InChIKey of 1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane?
The InChIKey is ZTQUXAZVYOAMCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClFNO.C2H2ClF.CH4/c7-5(8)4-9-3-1-2-6(9)10;1-2(3)4;/h4H,1-3H2;1H2;1H4.
What are the key properties of 1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane?
1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane has a molecular weight of 260.11 g/mol, XLogP of 3.92, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane is sourced from PubChem (CID 162217428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).