(E)-4-bromooct-4-ene

C8H15Br — CID 13093303

IUPAC(E)-4-bromooct-4-ene
SMILESCCC/C=C(/Br)CCC
InChIInChI=1S/C8H15Br/c1-3-5-7-8(9)6-4-2/h7H,3-6H2,1-2H3/b8-7+
InChIKeyDZFWCWSQNWCLIS-BQYQJAHWSA-N
MW191.11 g/mol
LogP3.87
Rot. Bonds4

About (E)-4-bromooct-4-ene

(E)-4-bromooct-4-ene (PubChem CID 13093303) has the molecular formula C8H15Br and a molecular weight of 191.11 g/mol. Its IUPAC name is (E)-4-bromooct-4-ene.

Molecular Properties

Compound Name(E)-4-bromooct-4-ene
PubChem CID13093303
Molecular FormulaC8H15Br
Molecular Weight191.11 g/mol
Exact Mass190.04
IUPAC Name(E)-4-bromooct-4-ene
SMILESCCC/C=C(/Br)CCC
InChIInChI=1S/C8H15Br/c1-3-5-7-8(9)6-4-2/h7H,3-6H2,1-2H3/b8-7+
InChIKeyDZFWCWSQNWCLIS-BQYQJAHWSA-N
XLogP3.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.11
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(Z)-2-bromohex-2-en-1-ol
CID 23238559
(E)-1,2-dibromopent-1-ene
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1-bromo-1-chloropent-1-ene
CID 535956
(E)-4-tert-butyloct-4-ene
CID 140632550
pent-1-ene-1,1-diol
CID 21473005
(Z)-5-bromonon-4-en-2-one
CID 101219247
triethyl-[(E)-oct-4-en-4-yl]-λ4-sulfane
CID 155264270
diethyl-[(Z)-oct-4-en-4-yl]alumane
CID 177486544
3-propylhept-3-en-2-one
CID 537652
4-ethynyloct-4-ene
CID 85203899
(4Z,6E)-2-bromo-4,5,6-tripropyldeca-1,4,6-triene
CID 177407414
(2E,6Z)-2,3,7-tribromonona-2,6-diene
CID 131969876

Frequently Asked Questions

What is the IUPAC name of (E)-4-bromooct-4-ene?
The IUPAC name of (E)-4-bromooct-4-ene (CID 13093303) is (E)-4-bromooct-4-ene.
What is the SMILES notation for (E)-4-bromooct-4-ene?
The canonical SMILES for (E)-4-bromooct-4-ene is CCC/C=C(/Br)CCC.
What is the InChIKey of (E)-4-bromooct-4-ene?
The InChIKey is DZFWCWSQNWCLIS-BQYQJAHWSA-N. The full InChI is InChI=1S/C8H15Br/c1-3-5-7-8(9)6-4-2/h7H,3-6H2,1-2H3/b8-7+.
What are the key properties of (E)-4-bromooct-4-ene?
(E)-4-bromooct-4-ene has a molecular weight of 191.11 g/mol, XLogP of 3.87, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-bromooct-4-ene is sourced from PubChem (CID 13093303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).