(Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene

C14H25F — CID 143728594

IUPAC(Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene
SMILESCC/C(C)=C\C(CC(C)CC)=C(\C)CF
InChIInChI=1S/C14H25F/c1-6-11(3)8-14(13(5)10-15)9-12(4)7-2/h8,12H,6-7,9-10H2,1-5H3/b11-8-,14-13+
InChIKeyQWGJITINPZWIBU-KBABRGLLSA-N
MW212.35 g/mol
LogP5.06
Rot. Bonds6

About (Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene

(Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene (PubChem CID 143728594) has the molecular formula C14H25F and a molecular weight of 212.35 g/mol. Its IUPAC name is (Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene.

Molecular Properties

Compound Name(Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene
PubChem CID143728594
Molecular FormulaC14H25F
Molecular Weight212.35 g/mol
Exact Mass212.19
IUPAC Name(Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene
SMILESCC/C(C)=C\C(CC(C)CC)=C(\C)CF
InChIInChI=1S/C14H25F/c1-6-11(3)8-14(13(5)10-15)9-12(4)7-2/h8,12H,6-7,9-10H2,1-5H3/b11-8-,14-13+
InChIKeyQWGJITINPZWIBU-KBABRGLLSA-N
XLogP5.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500212.35
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

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4,6-dimethyloct-3-en-2-ol
CID 91470833
(2E,4E)-5-methyl-3-propan-2-ylhepta-2,4-dien-2-ol
CID 143347257
(Z,3E)-6-butan-2-ylidene-3-ethylidene-2,8-dimethyldec-4-en-2-ol
CID 163390649
3-ethyl-5-methylhept-2-ene
CID 90962982
(2E,4Z)-2-methoxy-5-methyl-3-propan-2-ylhepta-2,4-diene
CID 143103707
N,2,5-trimethylhept-2-en-3-amine
CID 177136361
(5R)-5-methylheptan-3-one
CID 6566014
(E,5S)-3,5-dimethylhept-3-ene
CID 25021557
(Z)-4,7-dimethylnon-4-ene
CID 143531390
(Z)-2,4-dimethylhex-3-ene
CID 5463169

Frequently Asked Questions

What is the IUPAC name of (Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene?
The IUPAC name of (Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene (CID 143728594) is (Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene.
What is the SMILES notation for (Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene?
The canonical SMILES for (Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene is CC/C(C)=C\C(CC(C)CC)=C(\C)CF.
What is the InChIKey of (Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene?
The InChIKey is QWGJITINPZWIBU-KBABRGLLSA-N. The full InChI is InChI=1S/C14H25F/c1-6-11(3)8-14(13(5)10-15)9-12(4)7-2/h8,12H,6-7,9-10H2,1-5H3/b11-8-,14-13+.
What are the key properties of (Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene?
(Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene has a molecular weight of 212.35 g/mol, XLogP of 5.06, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,5Z)-5-(1-fluoropropan-2-ylidene)-3,7-dimethylnon-3-ene is sourced from PubChem (CID 143728594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).