(Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene

C12H12F12 — CID 10833880

IUPAC(Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene
SMILESCCCC/C=C\C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C12H12F12/c1-2-3-4-5-6-8(15,16)10(19,20)12(23,24)11(21,22)9(17,18)7(13)14/h5-7H,2-4H2,1H3/b6-5-
InChIKeyWRKHZIFAFUVOHR-WAYWQWQTSA-N
MW384.20 g/mol
LogP6.17
Rot. Bonds9

About (Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene

(Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene (PubChem CID 10833880) has the molecular formula C12H12F12 and a molecular weight of 384.20 g/mol. Its IUPAC name is (Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene.

Molecular Properties

Compound Name(Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene
PubChem CID10833880
Molecular FormulaC12H12F12
Molecular Weight384.20 g/mol
Exact Mass384.07
IUPAC Name(Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene
SMILESCCCC/C=C\C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C12H12F12/c1-2-3-4-5-6-8(15,16)10(19,20)12(23,24)11(21,22)9(17,18)7(13)14/h5-7H,2-4H2,1H3/b6-5-
InChIKeyWRKHZIFAFUVOHR-WAYWQWQTSA-N
XLogP6.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.20
LogP ≤ 56.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Analyze (Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene with MolForge

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Related Compounds

(E)-9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-heptadecafluorohexadec-7-ene
CID 12820302
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorododecane
CID 163290372
1,1,1-trifluorohept-2-ene
CID 2782636
(E)-6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-pentadecafluorododec-4-ene
CID 98453175
1,1,1,2,2,3,3,4-octafluorodec-5-ene
CID 174407621
2,2-dimethyloct-3-enethial
CID 154411834
5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12-hexadecafluorononadec-3-ene
CID 123318581
(7E,15E)-1,1,2,2,3,3,4,4,5,5,6,6,17,17,18,18,19,19,20,20,21,21,22,22-tetracosafluoro-1,22-diiododocosa-7,15-diene
CID 161473433
3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-hexadecafluorodecyl (Z)-octadec-9-enoate
CID 139714175
1,1,2,2,3,3,4,4-octafluorodecane
CID 10613179
(Z)-5-ethyl-5-fluorododec-6-ene
CID 84820815
1,1,1,2-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)oct-3-ene
CID 2776684

Frequently Asked Questions

What is the IUPAC name of (Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene?
The IUPAC name of (Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene (CID 10833880) is (Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene.
What is the SMILES notation for (Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene?
The canonical SMILES for (Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene is CCCC/C=C\C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F.
What is the InChIKey of (Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene?
The InChIKey is WRKHZIFAFUVOHR-WAYWQWQTSA-N. The full InChI is InChI=1S/C12H12F12/c1-2-3-4-5-6-8(15,16)10(19,20)12(23,24)11(21,22)9(17,18)7(13)14/h5-7H,2-4H2,1H3/b6-5-.
What are the key properties of (Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene?
(Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene has a molecular weight of 384.20 g/mol, XLogP of 6.17, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-7,7,8,8,9,9,10,10,11,11,12,12-dodecafluorododec-5-ene is sourced from PubChem (CID 10833880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).