1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene

C10F12 — CID 600110

IUPAC1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene
SMILESFC1=C(F)C2(F)C3(F)C(F)=C(F)C(F)(C3(F)F)C2(F)C1(F)F
InChIInChI=1S/C10F12/c11-1-2(12)7(17)9(20)5(15,6(1,16)10(7,21)22)3(13)4(14)8(9,18)19
InChIKeyJWLKYWSQXBLDPM-UHFFFAOYSA-N
MW348.09 g/mol
LogP4.43
Rot. Bonds

About 1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene

1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene (PubChem CID 600110) has the molecular formula C10F12 and a molecular weight of 348.09 g/mol. Its IUPAC name is 1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene.

Molecular Properties

Compound Name1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene
PubChem CID600110
Molecular FormulaC10F12
Molecular Weight348.09 g/mol
Exact Mass347.98
IUPAC Name1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene
SMILESFC1=C(F)C2(F)C3(F)C(F)=C(F)C(F)(C3(F)F)C2(F)C1(F)F
InChIInChI=1S/C10F12/c11-1-2(12)7(17)9(20)5(15,6(1,16)10(7,21)22)3(13)4(14)8(9,18)19
InChIKeyJWLKYWSQXBLDPM-UHFFFAOYSA-N
XLogP4.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.09
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

CID 20802230
CID 20802230
CID 60058125
CID 60058125
CID 21731944
CID 21731944
CID 101067141
CID 101067141

Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene?
The IUPAC name of 1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene (CID 600110) is 1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene.
What is the SMILES notation for 1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene?
The canonical SMILES for 1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene is FC1=C(F)C2(F)C3(F)C(F)=C(F)C(F)(C3(F)F)C2(F)C1(F)F.
What is the InChIKey of 1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene?
The InChIKey is JWLKYWSQXBLDPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10F12/c11-1-2(12)7(17)9(20)5(15,6(1,16)10(7,21)22)3(13)4(14)8(9,18)19.
What are the key properties of 1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene?
1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene has a molecular weight of 348.09 g/mol, XLogP of 4.43, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,5,6,7,8,9,10,10-dodecafluorotricyclo[5.2.1.02,6]deca-3,8-diene is sourced from PubChem (CID 600110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).