(1E,8E)-1,8-dibromocyclotetradeca-1,8-diene

C14H22Br2 — CID 11792107

IUPAC(1E,8E)-1,8-dibromocyclotetradeca-1,8-diene
SMILESBr/C1=C/CCCCC/C(Br)=C\CCCCC1
InChIInChI=1S/C14H22Br2/c15-13-9-5-1-2-6-10-14(16)12-8-4-3-7-11-13/h9,12H,1-8,10-11H2/b13-9+,14-12+
InChIKeySIVLOJMEFYHWPC-IHJNGOQESA-N
MW350.14 g/mol
LogP6.46
Rot. Bonds

About (1E,8E)-1,8-dibromocyclotetradeca-1,8-diene

(1E,8E)-1,8-dibromocyclotetradeca-1,8-diene (PubChem CID 11792107) has the molecular formula C14H22Br2 and a molecular weight of 350.14 g/mol. Its IUPAC name is (1E,8E)-1,8-dibromocyclotetradeca-1,8-diene.

Molecular Properties

Compound Name(1E,8E)-1,8-dibromocyclotetradeca-1,8-diene
PubChem CID11792107
Molecular FormulaC14H22Br2
Molecular Weight350.14 g/mol
Exact Mass348.01
IUPAC Name(1E,8E)-1,8-dibromocyclotetradeca-1,8-diene
SMILESBr/C1=C/CCCCC/C(Br)=C\CCCCC1
InChIInChI=1S/C14H22Br2/c15-13-9-5-1-2-6-10-14(16)12-8-4-3-7-11-13/h9,12H,1-8,10-11H2/b13-9+,14-12+
InChIKeySIVLOJMEFYHWPC-IHJNGOQESA-N
XLogP6.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.14
LogP ≤ 56.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(1E)-1-bromocyclododecene
CID 12594202
1-bromocyclohexene
CID 519775
(1E)-1-bromo-8-methylidenecyclooctene
CID 102038529
1-(cyclodecen-1-yl)cyclodecene
CID 54296371
(1E)-1-[(1E)-cyclopentadecen-1-yl]cyclopentadecene
CID 139760940
lithium (1E)-cyclododecen-1-olate
CID 23682255
1-(cyclopenten-1-yl)cyclooctene
CID 91463872
(1E)-1-iodocyclononene
CID 169083106
(1Z)-cyclododecen-1-ol
CID 69035385
cyclohexadecen-1-amine
CID 175415425
cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane
CID 173167887
1-iodocyclodecene
CID 72665352

Frequently Asked Questions

What is the IUPAC name of (1E,8E)-1,8-dibromocyclotetradeca-1,8-diene?
The IUPAC name of (1E,8E)-1,8-dibromocyclotetradeca-1,8-diene (CID 11792107) is (1E,8E)-1,8-dibromocyclotetradeca-1,8-diene.
What is the SMILES notation for (1E,8E)-1,8-dibromocyclotetradeca-1,8-diene?
The canonical SMILES for (1E,8E)-1,8-dibromocyclotetradeca-1,8-diene is Br/C1=C/CCCCC/C(Br)=C\CCCCC1.
What is the InChIKey of (1E,8E)-1,8-dibromocyclotetradeca-1,8-diene?
The InChIKey is SIVLOJMEFYHWPC-IHJNGOQESA-N. The full InChI is InChI=1S/C14H22Br2/c15-13-9-5-1-2-6-10-14(16)12-8-4-3-7-11-13/h9,12H,1-8,10-11H2/b13-9+,14-12+.
What are the key properties of (1E,8E)-1,8-dibromocyclotetradeca-1,8-diene?
(1E,8E)-1,8-dibromocyclotetradeca-1,8-diene has a molecular weight of 350.14 g/mol, XLogP of 6.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1E,8E)-1,8-dibromocyclotetradeca-1,8-diene is sourced from PubChem (CID 11792107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).