(2E,4Z)-1,3-difluorohepta-2,4-diene

C7H10F2 — CID 142242505

IUPAC(2E,4Z)-1,3-difluorohepta-2,4-diene
SMILESCC/C=C\C(F)=C/CF
InChIInChI=1S/C7H10F2/c1-2-3-4-7(9)5-6-8/h3-5H,2,6H2,1H3/b4-3-,7-5+
InChIKeyVTWCQFWDGHPXNQ-QVXLNCAUSA-N
MW132.15 g/mol
LogP2.78
Rot. Bonds3

About (2E,4Z)-1,3-difluorohepta-2,4-diene

(2E,4Z)-1,3-difluorohepta-2,4-diene (PubChem CID 142242505) has the molecular formula C7H10F2 and a molecular weight of 132.15 g/mol. Its IUPAC name is (2E,4Z)-1,3-difluorohepta-2,4-diene.

Molecular Properties

Compound Name(2E,4Z)-1,3-difluorohepta-2,4-diene
PubChem CID142242505
Molecular FormulaC7H10F2
Molecular Weight132.15 g/mol
Exact Mass132.08
IUPAC Name(2E,4Z)-1,3-difluorohepta-2,4-diene
SMILESCC/C=C\C(F)=C/CF
InChIInChI=1S/C7H10F2/c1-2-3-4-7(9)5-6-8/h3-5H,2,6H2,1H3/b4-3-,7-5+
InChIKeyVTWCQFWDGHPXNQ-QVXLNCAUSA-N
XLogP2.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.15
LogP ≤ 52.78
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

(2E)-3-fluorohepta-2,4-diene
CID 143797404
(3E,5E,6Z)-5-(2-fluoroethylidene)-2-methylnona-1,3,6-triene
CID 137451315
N-[(1E,3E)-2-fluorohexa-1,3-dienyl]methanimine
CID 165151838
acetylene;(2E,4Z)-2-fluoro-3-methylhepta-2,4-diene
CID 142928333
1,3-difluorobut-2-ene
CID 157259439
(3E,5Z)-4-methylocta-3,5-diene
CID 171633334
(Z)-N,2-dimethylhept-4-en-3-imine;ethane
CID 156795544
(2Z,4Z)-1-fluoro-4-propylhepta-2,4-diene
CID 143996817
ethane;(3Z)-2-methylhexa-1,3-diene
CID 142130371
(E)-pent-2-enoic acid
CID 638122
hexane;hex-3-en-2-one
CID 159035878
(3Z,5E)-6,7-difluoro-5-methylnona-3,5-diene
CID 167105692

Frequently Asked Questions

What is the IUPAC name of (2E,4Z)-1,3-difluorohepta-2,4-diene?
The IUPAC name of (2E,4Z)-1,3-difluorohepta-2,4-diene (CID 142242505) is (2E,4Z)-1,3-difluorohepta-2,4-diene.
What is the SMILES notation for (2E,4Z)-1,3-difluorohepta-2,4-diene?
The canonical SMILES for (2E,4Z)-1,3-difluorohepta-2,4-diene is CC/C=C\C(F)=C/CF.
What is the InChIKey of (2E,4Z)-1,3-difluorohepta-2,4-diene?
The InChIKey is VTWCQFWDGHPXNQ-QVXLNCAUSA-N. The full InChI is InChI=1S/C7H10F2/c1-2-3-4-7(9)5-6-8/h3-5H,2,6H2,1H3/b4-3-,7-5+.
What are the key properties of (2E,4Z)-1,3-difluorohepta-2,4-diene?
(2E,4Z)-1,3-difluorohepta-2,4-diene has a molecular weight of 132.15 g/mol, XLogP of 2.78, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4Z)-1,3-difluorohepta-2,4-diene is sourced from PubChem (CID 142242505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).