1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene

C10F16O — CID 173370354

IUPAC1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene
SMILESFC(F)=C(F)C(F)(F)C(F)=C(F)OC(F)=C(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10F16O/c11-1(4(14)15)7(18,19)2(12)5(16)27-6(17)3(13)8(20,21)9(22,23)10(24,25)26
InChIKeyZCMTXDMMRNPWTO-UHFFFAOYSA-N
MW440.08 g/mol
LogP6.76
Rot. Bonds6

About 1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene

1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene (PubChem CID 173370354) has the molecular formula C10F16O and a molecular weight of 440.08 g/mol. Its IUPAC name is 1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene.

Molecular Properties

Compound Name1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene
PubChem CID173370354
Molecular FormulaC10F16O
Molecular Weight440.08 g/mol
Exact Mass439.97
IUPAC Name1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene
SMILESFC(F)=C(F)C(F)(F)C(F)=C(F)OC(F)=C(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10F16O/c11-1(4(14)15)7(18,19)2(12)5(16)27-6(17)3(13)8(20,21)9(22,23)10(24,25)26
InChIKeyZCMTXDMMRNPWTO-UHFFFAOYSA-N
XLogP6.76
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.08
LogP ≤ 56.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

1,1,2,3,3,4,4,5,5,5-decafluoropent-1-ene;dihydrate
CID 139608619
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CID 172692823
8-(7-cyano-1,2,3,3,4,4,5,5,6,6,7,7-dodecafluorohept-1-enoxy)-2,2,3,3,4,4,5,5,6,6,7,8-dodecafluorooct-7-enenitrile
CID 173310680
1,1,1,2,2,3,3,4,4-nonafluoro-5-(1,2,3,3,4,4,5,5,5-nonafluoropent-1-enoxy)pentane
CID 175759723
1,2,3,4,4,5,5,5-octafluoro-1-[1,2,3,4,4,5,5,5-octafluoro-3-(trifluoromethoxy)pent-1-enoxy]-3-(trifluoromethoxy)pent-1-ene
CID 173022042
1,2,3,3,3-pentafluoro-1-(1,2,3,3,3-pentafluoroprop-1-enoxy)prop-1-ene
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1,1,1,2,2,3,3,4,4,5,6,7,7,8,8,9,9,10,10,11,11,12,12,12-tetracosafluorododec-5-ene
CID 85237088
1,1,2,3,3,4,4,5,5-nonafluoro-5-(1,2,2-trifluoroethenoxy)pent-1-ene
CID 14496010
1,2,3,3,4,4,5,5,5-nonafluoro-1-pentoxypent-1-ene
CID 175759689
1,1,2,3,3,4,4,5,5,6,6-undecafluorohept-1-ene
CID 87084377
1,1,2,3,3,4,4,5,5-nonafluoro-5-(1,1,2,2,3,3,4,5,5-nonafluoropent-4-enoxy)pent-1-ene
CID 87892167
1,2,3,3,4,4,5,5,6,6,6-undecafluoro-1-(2,2,3,3,3-pentafluoropropoxy)hex-1-ene
CID 175759797

Frequently Asked Questions

What is the IUPAC name of 1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene?
The IUPAC name of 1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene (CID 173370354) is 1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene.
What is the SMILES notation for 1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene?
The canonical SMILES for 1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene is FC(F)=C(F)C(F)(F)C(F)=C(F)OC(F)=C(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene?
The InChIKey is ZCMTXDMMRNPWTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10F16O/c11-1(4(14)15)7(18,19)2(12)5(16)27-6(17)3(13)8(20,21)9(22,23)10(24,25)26.
What are the key properties of 1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene?
1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene has a molecular weight of 440.08 g/mol, XLogP of 6.76, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,3,4,4,5,5,5-nonafluoro-1-(1,2,3,3,4,5,5-heptafluoropenta-1,4-dienoxy)pent-1-ene is sourced from PubChem (CID 173370354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).