(4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene

C10H13F — CID 144513621

IUPAC(4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene
SMILESC=C(C)C(=C)/C(F)=C\C=C/C
InChIInChI=1S/C10H13F/c1-5-6-7-10(11)9(4)8(2)3/h5-7H,2,4H2,1,3H3/b6-5-,10-7+
InChIKeyDKHPSXLVWMNKIL-ZZWPSLBBSA-N
MW152.21 g/mol
LogP3.55
Rot. Bonds3

About (4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene

(4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene (PubChem CID 144513621) has the molecular formula C10H13F and a molecular weight of 152.21 g/mol. Its IUPAC name is (4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene.

Molecular Properties

Compound Name(4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene
PubChem CID144513621
Molecular FormulaC10H13F
Molecular Weight152.21 g/mol
Exact Mass152.10
IUPAC Name(4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene
SMILESC=C(C)C(=C)/C(F)=C\C=C/C
InChIInChI=1S/C10H13F/c1-5-6-7-10(11)9(4)8(2)3/h5-7H,2,4H2,1,3H3/b6-5-,10-7+
InChIKeyDKHPSXLVWMNKIL-ZZWPSLBBSA-N
XLogP3.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.21
LogP ≤ 53.55
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

(3E)-3-fluoro-2-methylpenta-1,3-diene
CID 13165650
(3E,5Z)-3-chloro-2-methylhepta-1,3,5-triene;ethane
CID 145128135
(3E,5Z)-2-methyl-N-(methylideneamino)hepta-1,3,5-trien-3-amine
CID 88960569
7-bromo-5-methyl-6-methylidenenona-2,4,7-triene
CID 123192453
methane;(2Z,4E,6E,8E)-5-prop-1-en-2-yldeca-2,4,6,8-tetraene
CID 163241404
N-[(1E,3Z)-1-iodopenta-1,3-dienyl]methanimine
CID 163860981
4-ethyl-3-fluoroocta-2,4,6-triene
CID 123568888
2,4-dimethyl-3-methylidenepenta-1,4-diene
CID 12913413
6-propan-2-ylidene-5-prop-1-en-2-ylnona-2,4,7-triene
CID 123924693
(2E,4Z)-N-methyl-2-prop-1-en-2-ylhexa-2,4-dien-1-amine
CID 142839677
(3E,5Z)-2-methylhepta-1,3,5-triene-3-sulfonamide
CID 142175169
(3E,5Z)-3-iodohepta-1,3,5-triene
CID 89257521

Frequently Asked Questions

What is the IUPAC name of (4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene?
The IUPAC name of (4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene (CID 144513621) is (4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene.
What is the SMILES notation for (4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene?
The canonical SMILES for (4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene is C=C(C)C(=C)/C(F)=C\C=C/C.
What is the InChIKey of (4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene?
The InChIKey is DKHPSXLVWMNKIL-ZZWPSLBBSA-N. The full InChI is InChI=1S/C10H13F/c1-5-6-7-10(11)9(4)8(2)3/h5-7H,2,4H2,1,3H3/b6-5-,10-7+.
What are the key properties of (4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene?
(4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene has a molecular weight of 152.21 g/mol, XLogP of 3.55, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,6Z)-4-fluoro-2-methyl-3-methylideneocta-1,4,6-triene is sourced from PubChem (CID 144513621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).