4,4-difluoro-3-methylidenetridec-1-ene

C14H24F2 — CID 135010777

IUPAC4,4-difluoro-3-methylidenetridec-1-ene
SMILESC=CC(=C)C(F)(F)CCCCCCCCC
InChIInChI=1S/C14H24F2/c1-4-6-7-8-9-10-11-12-14(15,16)13(3)5-2/h5H,2-4,6-12H2,1H3
InChIKeyVCMWFHSDPPZOGH-UHFFFAOYSA-N
MW230.34 g/mol
LogP5.50
Rot. Bonds10

About 4,4-difluoro-3-methylidenetridec-1-ene

4,4-difluoro-3-methylidenetridec-1-ene (PubChem CID 135010777) has the molecular formula C14H24F2 and a molecular weight of 230.34 g/mol. Its IUPAC name is 4,4-difluoro-3-methylidenetridec-1-ene.

Molecular Properties

Compound Name4,4-difluoro-3-methylidenetridec-1-ene
PubChem CID135010777
Molecular FormulaC14H24F2
Molecular Weight230.34 g/mol
Exact Mass230.18
IUPAC Name4,4-difluoro-3-methylidenetridec-1-ene
SMILESC=CC(=C)C(F)(F)CCCCCCCCC
InChIInChI=1S/C14H24F2/c1-4-6-7-8-9-10-11-12-14(15,16)13(3)5-2/h5H,2-4,6-12H2,1H3
InChIKeyVCMWFHSDPPZOGH-UHFFFAOYSA-N
XLogP5.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500230.34
LogP ≤ 55.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

5-buta-1,3-dien-2-ylnonan-5-amine
CID 90407495
9-fluoropentacosan-9-ol
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7-pentyltridecan-7-yl prop-2-enoate
CID 166072578
7-hexylhexadecan-7-ol
CID 141253911
1,1,1-trifluorohexadecane
CID 15685316
9-octyloctadecan-9-ol
CID 150674168
7-pentylpentadecan-7-ol
CID 12913436
ethenol;heptadecane
CID 158851930
19-hexadecyl-19-nonylnonatriacontane
CID 90913331
9,9-dioctyloctadecane
CID 19690418
6,6-dipentylpentadecane
CID 152650171
8-hexyl-8-pentylhexadecane
CID 521602

Frequently Asked Questions

What is the IUPAC name of 4,4-difluoro-3-methylidenetridec-1-ene?
The IUPAC name of 4,4-difluoro-3-methylidenetridec-1-ene (CID 135010777) is 4,4-difluoro-3-methylidenetridec-1-ene.
What is the SMILES notation for 4,4-difluoro-3-methylidenetridec-1-ene?
The canonical SMILES for 4,4-difluoro-3-methylidenetridec-1-ene is C=CC(=C)C(F)(F)CCCCCCCCC.
What is the InChIKey of 4,4-difluoro-3-methylidenetridec-1-ene?
The InChIKey is VCMWFHSDPPZOGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24F2/c1-4-6-7-8-9-10-11-12-14(15,16)13(3)5-2/h5H,2-4,6-12H2,1H3.
What are the key properties of 4,4-difluoro-3-methylidenetridec-1-ene?
4,4-difluoro-3-methylidenetridec-1-ene has a molecular weight of 230.34 g/mol, XLogP of 5.50, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluoro-3-methylidenetridec-1-ene is sourced from PubChem (CID 135010777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).