cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane

C12H10F10 — CID 10807360

IUPACcis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane
SMILESF/C(=C(\F)C(F)(F)F)[C@@H]1CCC[C@H](/C(F)=C(/F)C(F)(F)F)C1
InChIInChI=1S/C12H10F10/c13-7(9(15)11(17,18)19)5-2-1-3-6(4-5)8(14)10(16)12(20,21)22/h5-6H,1-4H2/b9-7-,10-8-/t5-,6+
InChIKeyMJBXHOZRVNWMAY-NFDCECIOSA-N
MW344.19 g/mol
LogP6.22
Rot. Bonds2

About cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane

cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane (PubChem CID 10807360) has the molecular formula C12H10F10 and a molecular weight of 344.19 g/mol. Its IUPAC name is cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane.

Molecular Properties

Compound Namecis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane
PubChem CID10807360
Molecular FormulaC12H10F10
Molecular Weight344.19 g/mol
Exact Mass344.06
IUPAC Namecis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane
SMILESF/C(=C(\F)C(F)(F)F)[C@@H]1CCC[C@H](/C(F)=C(/F)C(F)(F)F)C1
InChIInChI=1S/C12H10F10/c13-7(9(15)11(17,18)19)5-2-1-3-6(4-5)8(14)10(16)12(20,21)22/h5-6H,1-4H2/b9-7-,10-8-/t5-,6+
InChIKeyMJBXHOZRVNWMAY-NFDCECIOSA-N
XLogP6.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.19
LogP ≤ 56.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane 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

[(Z)-Pentafluoro-1-propenyl]cyclohexane
CID 10751111
[(E)-1,1,1,2-tetrafluorohept-2-en-3-yl]cyclohexane
CID 11747114
1-Cyclohexyl-2,3,3,3-tetrafluoro-1-propene
CID 15497043
1-Fluoro-4-(1,2,2-trifluoroethenyl)cyclohexane
CID 19961274
[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]cyclohexane
CID 145627139
1-(1,1,1,3,3,3-Hexafluoropropan-2-ylidene)-4-methylcyclohexane
CID 146803790
2-Fluoro-4-methyl-1-(trifluoromethyl)cyclohexene
CID 146937347
1,2,3,3,4,4,5,5,6-Nonafluoro-6-(2-fluoroethyl)cyclohexene
CID 153895901
1,2,3,3,4,4,5,5-Octafluoro-6-propan-2-ylcyclohexene
CID 170071201
1,2,3,4,5,5,6-Heptafluoro-4-methyl-3-propan-2-ylcyclohexene
CID 175034555
1,4-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane
CID 10497592
[(E)-2,3,3,3-tetrafluoroprop-1-enyl]cyclohexane
CID 10856391

Frequently Asked Questions

What is the IUPAC name of cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane?
The IUPAC name of cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane (CID 10807360) is cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane.
What is the SMILES notation for cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane?
The canonical SMILES for cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane is F/C(=C(\F)C(F)(F)F)[C@@H]1CCC[C@H](/C(F)=C(/F)C(F)(F)F)C1.
What is the InChIKey of cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane?
The InChIKey is MJBXHOZRVNWMAY-NFDCECIOSA-N. The full InChI is InChI=1S/C12H10F10/c13-7(9(15)11(17,18)19)5-2-1-3-6(4-5)8(14)10(16)12(20,21)22/h5-6H,1-4H2/b9-7-,10-8-/t5-,6+.
What are the key properties of cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane?
cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane has a molecular weight of 344.19 g/mol, XLogP of 6.22, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,3R)-1,3-bis[(Z)-1,2,3,3,3-pentafluoroprop-1-enyl]cyclohexane is sourced from PubChem (CID 10807360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).