(7Z)-2,8-dibromoocta-1,7-dien-4-ol

C8H12Br2O — CID 134963518

IUPAC(7Z)-2,8-dibromoocta-1,7-dien-4-ol
SMILESC=C(Br)CC(O)CC/C=C\Br
InChIInChI=1S/C8H12Br2O/c1-7(10)6-8(11)4-2-3-5-9/h3,5,8,11H,1-2,4,6H2/b5-3-
InChIKeyCCKJZBNEPQBUKW-HYXAFXHYSA-N
MW283.99 g/mol
LogP3.33
Rot. Bonds5

About (7Z)-2,8-dibromoocta-1,7-dien-4-ol

(7Z)-2,8-dibromoocta-1,7-dien-4-ol (PubChem CID 134963518) has the molecular formula C8H12Br2O and a molecular weight of 283.99 g/mol. Its IUPAC name is (7Z)-2,8-dibromoocta-1,7-dien-4-ol.

Molecular Properties

Compound Name(7Z)-2,8-dibromoocta-1,7-dien-4-ol
PubChem CID134963518
Molecular FormulaC8H12Br2O
Molecular Weight283.99 g/mol
Exact Mass281.93
IUPAC Name(7Z)-2,8-dibromoocta-1,7-dien-4-ol
SMILESC=C(Br)CC(O)CC/C=C\Br
InChIInChI=1S/C8H12Br2O/c1-7(10)6-8(11)4-2-3-5-9/h3,5,8,11H,1-2,4,6H2/b5-3-
InChIKeyCCKJZBNEPQBUKW-HYXAFXHYSA-N
XLogP3.33
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.99
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (7Z)-2,8-dibromoocta-1,7-dien-4-ol?
The IUPAC name of (7Z)-2,8-dibromoocta-1,7-dien-4-ol (CID 134963518) is (7Z)-2,8-dibromoocta-1,7-dien-4-ol.
What is the SMILES notation for (7Z)-2,8-dibromoocta-1,7-dien-4-ol?
The canonical SMILES for (7Z)-2,8-dibromoocta-1,7-dien-4-ol is C=C(Br)CC(O)CC/C=C\Br.
What is the InChIKey of (7Z)-2,8-dibromoocta-1,7-dien-4-ol?
The InChIKey is CCKJZBNEPQBUKW-HYXAFXHYSA-N. The full InChI is InChI=1S/C8H12Br2O/c1-7(10)6-8(11)4-2-3-5-9/h3,5,8,11H,1-2,4,6H2/b5-3-.
What are the key properties of (7Z)-2,8-dibromoocta-1,7-dien-4-ol?
(7Z)-2,8-dibromoocta-1,7-dien-4-ol has a molecular weight of 283.99 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7Z)-2,8-dibromoocta-1,7-dien-4-ol is sourced from PubChem (CID 134963518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).