1,1-difluoro-3,3-dimethylbut-1-ene

C6H10F2 — CID 11542776

IUPAC1,1-difluoro-3,3-dimethylbut-1-ene
SMILESCC(C)(C)C=C(F)F
InChIInChI=1S/C6H10F2/c1-6(2,3)4-5(7)8/h4H,1-3H3
InChIKeyINULZSMMLUZJAL-UHFFFAOYSA-N
MW120.14 g/mol
LogP2.81
Rot. Bonds

About 1,1-difluoro-3,3-dimethylbut-1-ene

1,1-difluoro-3,3-dimethylbut-1-ene (PubChem CID 11542776) has the molecular formula C6H10F2 and a molecular weight of 120.14 g/mol. Its IUPAC name is 1,1-difluoro-3,3-dimethylbut-1-ene.

Molecular Properties

Compound Name1,1-difluoro-3,3-dimethylbut-1-ene
PubChem CID11542776
Molecular FormulaC6H10F2
Molecular Weight120.14 g/mol
Exact Mass120.08
IUPAC Name1,1-difluoro-3,3-dimethylbut-1-ene
SMILESCC(C)(C)C=C(F)F
InChIInChI=1S/C6H10F2/c1-6(2,3)4-5(7)8/h4H,1-3H3
InChIKeyINULZSMMLUZJAL-UHFFFAOYSA-N
XLogP2.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.14
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-3,3-dimethylbut-1-ene?
The IUPAC name of 1,1-difluoro-3,3-dimethylbut-1-ene (CID 11542776) is 1,1-difluoro-3,3-dimethylbut-1-ene.
What is the SMILES notation for 1,1-difluoro-3,3-dimethylbut-1-ene?
The canonical SMILES for 1,1-difluoro-3,3-dimethylbut-1-ene is CC(C)(C)C=C(F)F.
What is the InChIKey of 1,1-difluoro-3,3-dimethylbut-1-ene?
The InChIKey is INULZSMMLUZJAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2/c1-6(2,3)4-5(7)8/h4H,1-3H3.
What are the key properties of 1,1-difluoro-3,3-dimethylbut-1-ene?
1,1-difluoro-3,3-dimethylbut-1-ene has a molecular weight of 120.14 g/mol, XLogP of 2.81, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-3,3-dimethylbut-1-ene is sourced from PubChem (CID 11542776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).