[(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite

C8H11FO — CID 143370205

IUPAC[(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite
SMILESC=C(C)/C=C\C(=C)COF
InChIInChI=1S/C8H11FO/c1-7(2)4-5-8(3)6-10-9/h4-5H,1,3,6H2,2H3/b5-4-
InChIKeyXVVKVOJHSIRJAI-PLNGDYQASA-N
MW142.17 g/mol
LogP2.58
Rot. Bonds4

About [(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite

[(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite (PubChem CID 143370205) has the molecular formula C8H11FO and a molecular weight of 142.17 g/mol. Its IUPAC name is [(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite.

Molecular Properties

Compound Name[(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite
PubChem CID143370205
Molecular FormulaC8H11FO
Molecular Weight142.17 g/mol
Exact Mass142.08
IUPAC Name[(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite
SMILESC=C(C)/C=C\C(=C)COF
InChIInChI=1S/C8H11FO/c1-7(2)4-5-8(3)6-10-9/h4-5H,1,3,6H2,2H3/b5-4-
InChIKeyXVVKVOJHSIRJAI-PLNGDYQASA-N
XLogP2.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.17
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-Ethenyl-6-methoxyhexa-1,3-diene
CID 134835479
4-Methylpenta-2,4-dienyl hypofluorite
CID 123720351
(2Z,4Z,6E)-6-(fluoromethylidene)-8-methoxyocta-2,4-diene
CID 130308041
(4-Methylcyclohepta-2,4,6-trien-1-yl) hypofluorite
CID 142204515
[(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite
CID 143873203
[(2E)-2-ethenyl-4-methylpenta-2,4-dienyl] hypofluorite
CID 143959247
[(3Z,5Z)-2-methylidenehepta-3,5-dienyl] hypofluorite
CID 144647262
(3E)-3-fluoro-2-(methoxymethyl)hexa-1,3,5-triene
CID 144867868
(2E,4Z,6E)-3-fluoro-9-methoxy-4-methylnona-2,4,6-triene
CID 145318056
[(2E)-2-ethenylpenta-2,4-dienyl] hypofluorite
CID 145378967
[(3E)-3-ethenylhexa-3,5-dien-2-yl] hypofluorite
CID 145379014
(3Z,5Z)-6-fluoro-5-(methoxymethyl)-2-methylhepta-1,3,5-triene
CID 145639548

Frequently Asked Questions

What is the IUPAC name of [(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite?
The IUPAC name of [(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite (CID 143370205) is [(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite.
What is the SMILES notation for [(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite?
The canonical SMILES for [(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite is C=C(C)/C=C\C(=C)COF.
What is the InChIKey of [(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite?
The InChIKey is XVVKVOJHSIRJAI-PLNGDYQASA-N. The full InChI is InChI=1S/C8H11FO/c1-7(2)4-5-8(3)6-10-9/h4-5H,1,3,6H2,2H3/b5-4-.
What are the key properties of [(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite?
[(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite has a molecular weight of 142.17 g/mol, XLogP of 2.58, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(3Z)-5-methyl-2-methylidenehexa-3,5-dienyl] hypofluorite is sourced from PubChem (CID 143370205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).