(3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene

C14H17F — CID 145480540

IUPAC(3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene
SMILESC=C(C)/C=C\C(=C)C(=C)/C(C)=C\C(=C)F
InChIInChI=1S/C14H17F/c1-10(2)7-8-11(3)14(6)12(4)9-13(5)15/h7-9H,1,3,5-6H2,2,4H3/b8-7-,12-9-
InChIKeyCZAULUOPSJKGKX-JNWHFCKMSA-N
MW204.29 g/mol
LogP4.66
Rot. Bonds5

About (3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene

(3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene (PubChem CID 145480540) has the molecular formula C14H17F and a molecular weight of 204.29 g/mol. Its IUPAC name is (3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene.

Molecular Properties

Compound Name(3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene
PubChem CID145480540
Molecular FormulaC14H17F
Molecular Weight204.29 g/mol
Exact Mass204.13
IUPAC Name(3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene
SMILESC=C(C)/C=C\C(=C)C(=C)/C(C)=C\C(=C)F
InChIInChI=1S/C14H17F/c1-10(2)7-8-11(3)14(6)12(4)9-13(5)15/h7-9H,1,3,5-6H2,2,4H3/b8-7-,12-9-
InChIKeyCZAULUOPSJKGKX-JNWHFCKMSA-N
XLogP4.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.29
LogP ≤ 54.66
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

(3Z,7Z)-2-fluoro-9-methyl-5,6-dimethylidenedeca-1,3,7,9-tetraene
CID 143485598
2,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene
CID 123828527
(3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene
CID 166131805
(5Z)-2-fluoro-10-methyl-3,4,7,8-tetramethylideneundeca-1,5,9-triene
CID 143773264
(3Z)-2,5-dimethylhexa-1,3,5-triene;(3E)-3-fluoro-2,5-dimethylhexa-1,3,5-triene
CID 145172629
(3Z)-2-fluoro-4-methyl-5-methylidenehepta-1,3-diene
CID 169164324
(3Z)-5-methylhexa-1,3,5-trien-2-ol;uranium
CID 143030811
(3Z)-5-methyl-2-methylidenehexa-3,5-dienoic acid
CID 142042516
ethane;(4Z)-6-methyl-3-methylidenehepta-1,4,6-trien-2-amine
CID 143072241
(3Z,7Z,11Z)-2-methyl-5,6,9,10-tetramethylidenetetradeca-1,3,7,11,13-pentaene
CID 143476273
(3Z,7Z,9Z)-2,9-dimethyl-5,6-dimethylideneundeca-1,3,7,9-tetraene;ethane
CID 143933748
(3Z,7E)-7-fluoro-5,6,9-trimethylideneundeca-1,3,7-trien-2-ol
CID 145234991

Frequently Asked Questions

What is the IUPAC name of (3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene?
The IUPAC name of (3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene (CID 145480540) is (3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene.
What is the SMILES notation for (3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene?
The canonical SMILES for (3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene is C=C(C)/C=C\C(=C)C(=C)/C(C)=C\C(=C)F.
What is the InChIKey of (3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene?
The InChIKey is CZAULUOPSJKGKX-JNWHFCKMSA-N. The full InChI is InChI=1S/C14H17F/c1-10(2)7-8-11(3)14(6)12(4)9-13(5)15/h7-9H,1,3,5-6H2,2,4H3/b8-7-,12-9-.
What are the key properties of (3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene?
(3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene has a molecular weight of 204.29 g/mol, XLogP of 4.66, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene is sourced from PubChem (CID 145480540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).