3-Fluoro-2,4-dimethylpent-2-ene

C7H13F — CID 23384922

IUPAC3-fluoro-2,4-dimethylpent-2-ene
SMILESCC(C)C(=C(C)C)F
InChIInChI=1S/C7H13F/c1-5(2)7(8)6(3)4/h5H,1-4H3
InChIKeyNZSJXJJPLMNOFZ-UHFFFAOYSA-N
MW116.18 g/mol
LogP2.90
Rot. Bonds1

About 3-Fluoro-2,4-dimethylpent-2-ene

3-Fluoro-2,4-dimethylpent-2-ene (PubChem CID 23384922) has the molecular formula C7H13F and a molecular weight of 116.18 g/mol. Its IUPAC name is 3-fluoro-2,4-dimethylpent-2-ene.

Molecular Properties

Compound Name3-Fluoro-2,4-dimethylpent-2-ene
PubChem CID23384922
Molecular FormulaC7H13F
Molecular Weight116.18 g/mol
Exact Mass116.10
IUPAC Name3-fluoro-2,4-dimethylpent-2-ene
SMILESCC(C)C(=C(C)C)F
InChIInChI=1S/C7H13F/c1-5(2)7(8)6(3)4/h5H,1-4H3
InChIKeyNZSJXJJPLMNOFZ-UHFFFAOYSA-N
XLogP2.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity97

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.18
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-Dimethyl-2-pentene
CID 25403
(Z)-1,1,1,3-tetrafluoro-2,4-dimethylpent-2-ene
CID 23384619
(Z)-2,3-difluoro-4-methylpent-2-ene
CID 23384767
(E)-2-fluoro-3,4-dimethylpent-2-ene
CID 23384807
(Z)-3,4-difluoro-2,5-dimethylhex-3-ene
CID 57779744
(E)-3-fluoro-2,4,5-trimethylhex-3-ene
CID 57779751
(E)-2,3-difluoro-4-methylpent-2-ene
CID 59910994
(E)-1,1,1,3-tetrafluoro-2,4-dimethylpent-2-ene
CID 59911452
(E)-2-fluoro-3-methylpent-2-ene
CID 60208605
2-Fluoro-3-methylpent-2-ene
CID 72683259
2-Methyl-3-(trifluoromethyl)pent-2-ene
CID 88070826
3,5-Difluoro-2-methylhex-2-ene
CID 88557386

Frequently Asked Questions

What is the IUPAC name of 3-Fluoro-2,4-dimethylpent-2-ene?
The IUPAC name of 3-Fluoro-2,4-dimethylpent-2-ene (CID 23384922) is 3-fluoro-2,4-dimethylpent-2-ene.
What is the SMILES notation for 3-Fluoro-2,4-dimethylpent-2-ene?
The canonical SMILES for 3-Fluoro-2,4-dimethylpent-2-ene is CC(C)C(=C(C)C)F.
What is the InChIKey of 3-Fluoro-2,4-dimethylpent-2-ene?
The InChIKey is NZSJXJJPLMNOFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F/c1-5(2)7(8)6(3)4/h5H,1-4H3.
What are the key properties of 3-Fluoro-2,4-dimethylpent-2-ene?
3-Fluoro-2,4-dimethylpent-2-ene has a molecular weight of 116.18 g/mol, XLogP of 2.90, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-Fluoro-2,4-dimethylpent-2-ene is sourced from PubChem (CID 23384922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).