(3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene

C12H19F — CID 144599508

IUPAC(3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene
SMILESC=C/C=C(/F)C(=C)C(C)CCCC
InChIInChI=1S/C12H19F/c1-5-7-9-10(3)11(4)12(13)8-6-2/h6,8,10H,2,4-5,7,9H2,1,3H3/b12-8+
InChIKeyRDWNRGSTNGYOQE-XYOKQWHBSA-N
MW182.28 g/mol
LogP4.41
Rot. Bonds6

About (3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene

(3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene (PubChem CID 144599508) has the molecular formula C12H19F and a molecular weight of 182.28 g/mol. Its IUPAC name is (3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene.

Molecular Properties

Compound Name(3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene
PubChem CID144599508
Molecular FormulaC12H19F
Molecular Weight182.28 g/mol
Exact Mass182.15
IUPAC Name(3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene
SMILESC=C/C=C(/F)C(=C)C(C)CCCC
InChIInChI=1S/C12H19F/c1-5-7-9-10(3)11(4)12(13)8-6-2/h6,8,10H,2,4-5,7,9H2,1,3H3/b12-8+
InChIKeyRDWNRGSTNGYOQE-XYOKQWHBSA-N
XLogP4.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.28
LogP ≤ 54.41
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

(Z,5Z)-6-methyl-5-prop-2-enylidenedec-3-ene
CID 144893155
(3Z,5Z,6R)-5-ethylidene-6-methyldeca-1,3-diene
CID 144579667
(E,3Z)-1-amino-4-methyl-3-prop-2-enylidenedec-1-en-1-ol
CID 167250897
(4R)-4-methyl-3-methylideneoctane
CID 10820618
(3Z)-4-[(E)-1-fluoroprop-1-enyl]-8-methoxy-6-methyl-5-methylideneocta-1,3-diene
CID 88905328
(3E)-3-ethylidene-N-methyloct-1-en-4-amine
CID 129132264
(3R,4R)-3-methyloct-1-en-4-ol
CID 13087267
(E)-N,3-bis(ethenyl)-4-methyldec-2-en-1-imine
CID 139315408
(3E,7E)-4-ethyl-7-fluoro-2-methyl-6-methylidenedeca-3,7,9-trien-5-one
CID 154979005
(2E,7Z,11Z,15Z)-7,8,15,16-tetrafluoro-18-methyl-6,9,10,13,14,17-hexamethylidenedocosa-2,7,11,15-tetraene
CID 143773258
(3E)-3-fluoro-5-methylhexa-1,3,5-trien-2-amine;2-methylhexane
CID 145379015
(2Z)-N-ethenyl-3-methyl-2-prop-2-enylidenenonanamide
CID 146604814

Frequently Asked Questions

What is the IUPAC name of (3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene?
The IUPAC name of (3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene (CID 144599508) is (3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene.
What is the SMILES notation for (3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene?
The canonical SMILES for (3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene is C=C/C=C(/F)C(=C)C(C)CCCC.
What is the InChIKey of (3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene?
The InChIKey is RDWNRGSTNGYOQE-XYOKQWHBSA-N. The full InChI is InChI=1S/C12H19F/c1-5-7-9-10(3)11(4)12(13)8-6-2/h6,8,10H,2,4-5,7,9H2,1,3H3/b12-8+.
What are the key properties of (3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene?
(3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene has a molecular weight of 182.28 g/mol, XLogP of 4.41, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-4-fluoro-6-methyl-5-methylidenedeca-1,3-diene is sourced from PubChem (CID 144599508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).