6-bromo-1,3,4,6-tetrafluorohex-1-ene

C6H7BrF4 — CID 155208912

IUPAC6-bromo-1,3,4,6-tetrafluorohex-1-ene
SMILESFC=CC(F)C(F)CC(F)Br
InChIInChI=1S/C6H7BrF4/c7-6(11)3-5(10)4(9)1-2-8/h1-2,4-6H,3H2
InChIKeyPUHPYEYQZUYVPA-UHFFFAOYSA-N
MW235.02 g/mol
LogP3.23
Rot. Bonds4

About 6-bromo-1,3,4,6-tetrafluorohex-1-ene

6-bromo-1,3,4,6-tetrafluorohex-1-ene (PubChem CID 155208912) has the molecular formula C6H7BrF4 and a molecular weight of 235.02 g/mol. Its IUPAC name is 6-bromo-1,3,4,6-tetrafluorohex-1-ene.

Molecular Properties

Compound Name6-bromo-1,3,4,6-tetrafluorohex-1-ene
PubChem CID155208912
Molecular FormulaC6H7BrF4
Molecular Weight235.02 g/mol
Exact Mass233.97
IUPAC Name6-bromo-1,3,4,6-tetrafluorohex-1-ene
SMILESFC=CC(F)C(F)CC(F)Br
InChIInChI=1S/C6H7BrF4/c7-6(11)3-5(10)4(9)1-2-8/h1-2,4-6H,3H2
InChIKeyPUHPYEYQZUYVPA-UHFFFAOYSA-N
XLogP3.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.02
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

1,2,4-trifluorobut-3-en-1-ol
CID 173323536
1,3,4,5,6,7,8,9,10,12-decafluorododec-1-ene
CID 173057318
1,3-dibromo-1,1,3-trifluoropropane
CID 45075709
1-bromo-1,2,3-trifluoropropane
CID 5463736
1,4,6-trifluorohex-1-en-3-yl carbamate
CID 175485462
(E)-6-fluoro-4-methylhex-5-enoic acid
CID 121320724
(1E,6Z)-1,3-difluoroocta-1,4,6-triene
CID 142242814
(4S)-4-bromo-2-fluoropentanal
CID 146406697
(1E)-3-chloro-1-fluorohexa-1,5-diene
CID 143327832
1,3-dibromo-2,4-difluorobutane
CID 23263192
3-bromo-1,2,3-trifluoroprop-1-ene
CID 173452706
1-bromo-1-(1-bromo-4,4-difluorobut-2-enoxy)-4,4-difluorobut-2-ene
CID 141435557

Frequently Asked Questions

What is the IUPAC name of 6-bromo-1,3,4,6-tetrafluorohex-1-ene?
The IUPAC name of 6-bromo-1,3,4,6-tetrafluorohex-1-ene (CID 155208912) is 6-bromo-1,3,4,6-tetrafluorohex-1-ene.
What is the SMILES notation for 6-bromo-1,3,4,6-tetrafluorohex-1-ene?
The canonical SMILES for 6-bromo-1,3,4,6-tetrafluorohex-1-ene is FC=CC(F)C(F)CC(F)Br.
What is the InChIKey of 6-bromo-1,3,4,6-tetrafluorohex-1-ene?
The InChIKey is PUHPYEYQZUYVPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7BrF4/c7-6(11)3-5(10)4(9)1-2-8/h1-2,4-6H,3H2.
What are the key properties of 6-bromo-1,3,4,6-tetrafluorohex-1-ene?
6-bromo-1,3,4,6-tetrafluorohex-1-ene has a molecular weight of 235.02 g/mol, XLogP of 3.23, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-1,3,4,6-tetrafluorohex-1-ene is sourced from PubChem (CID 155208912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).