(E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene

C3HBr2F3 — CID 11658898

IUPAC(E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene
SMILESFC(F)(F)/C(Br)=C\Br
InChIInChI=1S/C3HBr2F3/c4-1-2(5)3(6,7)8/h1H/b2-1+
InChIKeyDCJYYAUJHDDEAA-OWOJBTEDSA-N
MW253.84 g/mol
LogP3.18
Rot. Bonds

About (E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene

(E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene (PubChem CID 11658898) has the molecular formula C3HBr2F3 and a molecular weight of 253.84 g/mol. Its IUPAC name is (E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene.

Molecular Properties

Compound Name(E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene
PubChem CID11658898
Molecular FormulaC3HBr2F3
Molecular Weight253.84 g/mol
Exact Mass251.84
IUPAC Name(E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene
SMILESFC(F)(F)/C(Br)=C\Br
InChIInChI=1S/C3HBr2F3/c4-1-2(5)3(6,7)8/h1H/b2-1+
InChIKeyDCJYYAUJHDDEAA-OWOJBTEDSA-N
XLogP3.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.84
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-Propene, 2-bromo-3,3,3-trifluoro-
CID 272696
1,2-Dibromo-3,3,3-trifluoropropene
CID 5702847
1,3-Dibromo-2,3,3-trifluoroprop-1-ene
CID 91726370
2,3-Dibromo-3,3-difluoroprop-1-ene
CID 2736763
1,2-Dibromo-3,3,3-trifluoroprop-1-ene
CID 2736808
1,2-Dibromo-3,3-difluoroprop-1-ene
CID 53649870
(E)-1,2-dibromo-3,3-difluoroprop-1-ene
CID 88842356
Bromoethane;2-bromo-3,3,3-trifluoroprop-1-ene
CID 145722751
1,2,3-Tribromo-3,3-difluoroprop-1-ene
CID 154151668
3-Bromo-1,1-difluoropropa-1,2-diene
CID 174189391
3,3-Dibromo-1,1,2-trifluoroprop-1-ene
CID 175013472
1,2-Dibromo-1,3,3-trifluoroprop-1-ene
CID 175013473

Frequently Asked Questions

What is the IUPAC name of (E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene?
The IUPAC name of (E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene (CID 11658898) is (E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene.
What is the SMILES notation for (E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene?
The canonical SMILES for (E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene is FC(F)(F)/C(Br)=C\Br.
What is the InChIKey of (E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene?
The InChIKey is DCJYYAUJHDDEAA-OWOJBTEDSA-N. The full InChI is InChI=1S/C3HBr2F3/c4-1-2(5)3(6,7)8/h1H/b2-1+.
What are the key properties of (E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene?
(E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene has a molecular weight of 253.84 g/mol, XLogP of 3.18, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,2-dibromo-3,3,3-trifluoroprop-1-ene is sourced from PubChem (CID 11658898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).