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

C12H13F — CID 143982603

IUPAC(3Z,7Z)-2-fluoro-5,6-dimethylidenedeca-1,3,7,9-tetraene
SMILESC=C/C=C\C(=C)C(=C)/C=C\C(=C)F
InChIInChI=1S/C12H13F/c1-5-6-7-10(2)11(3)8-9-12(4)13/h5-9H,1-4H2/b7-6-,9-8-
InChIKeyOBWVIUJGJNMJIL-JPDBVBESSA-N
MW176.23 g/mol
LogP3.88
Rot. Bonds5

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

(3Z,7Z)-2-fluoro-5,6-dimethylidenedeca-1,3,7,9-tetraene (PubChem CID 143982603) has the molecular formula C12H13F and a molecular weight of 176.23 g/mol. Its IUPAC name is (3Z,7Z)-2-fluoro-5,6-dimethylidenedeca-1,3,7,9-tetraene.

Molecular Properties

Compound Name(3Z,7Z)-2-fluoro-5,6-dimethylidenedeca-1,3,7,9-tetraene
PubChem CID143982603
Molecular FormulaC12H13F
Molecular Weight176.23 g/mol
Exact Mass176.10
IUPAC Name(3Z,7Z)-2-fluoro-5,6-dimethylidenedeca-1,3,7,9-tetraene
SMILESC=C/C=C\C(=C)C(=C)/C=C\C(=C)F
InChIInChI=1S/C12H13F/c1-5-6-7-10(2)11(3)8-9-12(4)13/h5-9H,1-4H2/b7-6-,9-8-
InChIKeyOBWVIUJGJNMJIL-JPDBVBESSA-N
XLogP3.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.23
LogP ≤ 53.88
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)-5,6-dimethylidenedeca-1,3,7,9-tetraene;methane
CID 156726265
(3Z,7Z,11Z)-2-methyl-5,6,9,10-tetramethylidenetetradeca-1,3,7,11,13-pentaene
CID 143476273
(3Z,7Z,11Z)-5,6,9,10-tetramethylidenetetradeca-1,3,7,11,13-pentaen-2-amine
CID 142405932
(3Z,7Z)-2-fluoro-9-methyl-5,6-dimethylidenedeca-1,3,7,9-tetraene
CID 143485598
2-methylidenehexa-3,5-dienoic acid;hydrate
CID 87513549
benzene;(3Z,7Z)-5,6-dimethylidenedeca-1,3,7,9-tetraene;ethane;methane
CID 164901853
6-methyl-5-methylidenehepta-1,3,6-triene
CID 54100301
(3Z,7Z,11Z)-7,8-difluoro-2,5,6,9,10-pentamethylidenetetradeca-3,7,11,13-tetraen-1-ol
CID 144676255
2-methylprop-2-enoyl 2-methylidenehexa-3,5-dienoate
CID 174764747
(3Z,7Z)-2,3-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene;ethane
CID 145064081
ethane;(3Z,6E)-6-methyl-5-methylideneocta-1,3,6-triene
CID 145268478
(2Z,7Z)-4,6-dimethylidenedeca-2,7,9-trien-5-one;ethane;prop-1-ene
CID 144870179

Frequently Asked Questions

What is the IUPAC name of (3Z,7Z)-2-fluoro-5,6-dimethylidenedeca-1,3,7,9-tetraene?
The IUPAC name of (3Z,7Z)-2-fluoro-5,6-dimethylidenedeca-1,3,7,9-tetraene (CID 143982603) is (3Z,7Z)-2-fluoro-5,6-dimethylidenedeca-1,3,7,9-tetraene.
What is the SMILES notation for (3Z,7Z)-2-fluoro-5,6-dimethylidenedeca-1,3,7,9-tetraene?
The canonical SMILES for (3Z,7Z)-2-fluoro-5,6-dimethylidenedeca-1,3,7,9-tetraene is C=C/C=C\C(=C)C(=C)/C=C\C(=C)F.
What is the InChIKey of (3Z,7Z)-2-fluoro-5,6-dimethylidenedeca-1,3,7,9-tetraene?
The InChIKey is OBWVIUJGJNMJIL-JPDBVBESSA-N. The full InChI is InChI=1S/C12H13F/c1-5-6-7-10(2)11(3)8-9-12(4)13/h5-9H,1-4H2/b7-6-,9-8-.
What are the key properties of (3Z,7Z)-2-fluoro-5,6-dimethylidenedeca-1,3,7,9-tetraene?
(3Z,7Z)-2-fluoro-5,6-dimethylidenedeca-1,3,7,9-tetraene has a molecular weight of 176.23 g/mol, XLogP of 3.88, 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-5,6-dimethylidenedeca-1,3,7,9-tetraene is sourced from PubChem (CID 143982603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).