(2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene

C9H14F2 — CID 142010132

IUPAC(2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene
SMILESCC/C(C)=C(\F)C/C=C(\C)F
InChIInChI=1S/C9H14F2/c1-4-7(2)9(11)6-5-8(3)10/h5H,4,6H2,1-3H3/b8-5+,9-7-
InChIKeyHBTNCSNFWDVFJM-KCGQVOQMSA-N
MW160.21 g/mol
LogP3.90
Rot. Bonds3

About (2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene

(2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene (PubChem CID 142010132) has the molecular formula C9H14F2 and a molecular weight of 160.21 g/mol. Its IUPAC name is (2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene.

Molecular Properties

Compound Name(2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene
PubChem CID142010132
Molecular FormulaC9H14F2
Molecular Weight160.21 g/mol
Exact Mass160.11
IUPAC Name(2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene
SMILESCC/C(C)=C(\F)C/C=C(\C)F
InChIInChI=1S/C9H14F2/c1-4-7(2)9(11)6-5-8(3)10/h5H,4,6H2,1-3H3/b8-5+,9-7-
InChIKeyHBTNCSNFWDVFJM-KCGQVOQMSA-N
XLogP3.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.21
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(2E,4Z)-2,4-difluoro-5-methylhepta-2,4-diene
CID 144768900
1,3-difluorobut-2-ene
CID 157259439
(Z)-3,4-difluorohex-3-ene
CID 143535367
4-fluoro-5-methylhepta-2,4-diene
CID 123466906
(2E)-2-fluoro-6-methylhepta-2,5-diene
CID 143576133
(E)-2-fluoro-5-methylhept-2-ene
CID 89043043
CID 123497420
CID 123497420
4-chloro-7-fluorooct-6-ene-3-thione
CID 123609692
2-fluoro-3-methylpent-2-enoic acid
CID 73188166
2,3-dimethylpent-2-ene;propane
CID 162031516
azane;2,3-dimethylpent-2-ene
CID 87285665
(2Z,4Z)-3,4,5-trimethylhepta-2,4-diene
CID 157171896

Frequently Asked Questions

What is the IUPAC name of (2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene?
The IUPAC name of (2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene (CID 142010132) is (2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene.
What is the SMILES notation for (2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene?
The canonical SMILES for (2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene is CC/C(C)=C(\F)C/C=C(\C)F.
What is the InChIKey of (2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene?
The InChIKey is HBTNCSNFWDVFJM-KCGQVOQMSA-N. The full InChI is InChI=1S/C9H14F2/c1-4-7(2)9(11)6-5-8(3)10/h5H,4,6H2,1-3H3/b8-5+,9-7-.
What are the key properties of (2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene?
(2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene has a molecular weight of 160.21 g/mol, XLogP of 3.90, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,5Z)-2,5-difluoro-6-methylocta-2,5-diene is sourced from PubChem (CID 142010132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).