(E)-2,5-dibromodec-3-ene

C10H18Br2 — CID 88755062

IUPAC(E)-2,5-dibromodec-3-ene
SMILESCCCCCC(Br)/C=C/C(C)Br
InChIInChI=1S/C10H18Br2/c1-3-4-5-6-10(12)8-7-9(2)11/h7-10H,3-6H2,1-2H3/b8-7+
InChIKeyNPFOYPDJZAEUIV-BQYQJAHWSA-N
MW298.06 g/mol
LogP4.67
Rot. Bonds6

About (E)-2,5-dibromodec-3-ene

(E)-2,5-dibromodec-3-ene (PubChem CID 88755062) has the molecular formula C10H18Br2 and a molecular weight of 298.06 g/mol. Its IUPAC name is (E)-2,5-dibromodec-3-ene.

Molecular Properties

Compound Name(E)-2,5-dibromodec-3-ene
PubChem CID88755062
Molecular FormulaC10H18Br2
Molecular Weight298.06 g/mol
Exact Mass295.98
IUPAC Name(E)-2,5-dibromodec-3-ene
SMILESCCCCCC(Br)/C=C/C(C)Br
InChIInChI=1S/C10H18Br2/c1-3-4-5-6-10(12)8-7-9(2)11/h7-10H,3-6H2,1-2H3/b8-7+
InChIKeyNPFOYPDJZAEUIV-BQYQJAHWSA-N
XLogP4.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.06
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(E)-5-bromododec-3-ene
CID 88753626
(E)-2-bromonon-3-ene
CID 88753535
3-bromoundec-1-ene
CID 15852002
2-bromo-4-methylundecane
CID 64721914
9,12-dibromo-13-hydroxynonadec-10-en-2-one
CID 58602066
6-bromopentadecane
CID 86639780
12-bromodotriacontane
CID 122613066
2-bromo-3-methylundecane
CID 63470862
3-bromo-2-methyldodecane
CID 63470480
3-bromo-2-methyldecane
CID 63470479
6,8-dimethylhexadecane
CID 91185725
N,N-di(tridecan-2-yl)tridecan-2-amine
CID 87098451

Frequently Asked Questions

What is the IUPAC name of (E)-2,5-dibromodec-3-ene?
The IUPAC name of (E)-2,5-dibromodec-3-ene (CID 88755062) is (E)-2,5-dibromodec-3-ene.
What is the SMILES notation for (E)-2,5-dibromodec-3-ene?
The canonical SMILES for (E)-2,5-dibromodec-3-ene is CCCCCC(Br)/C=C/C(C)Br.
What is the InChIKey of (E)-2,5-dibromodec-3-ene?
The InChIKey is NPFOYPDJZAEUIV-BQYQJAHWSA-N. The full InChI is InChI=1S/C10H18Br2/c1-3-4-5-6-10(12)8-7-9(2)11/h7-10H,3-6H2,1-2H3/b8-7+.
What are the key properties of (E)-2,5-dibromodec-3-ene?
(E)-2,5-dibromodec-3-ene has a molecular weight of 298.06 g/mol, XLogP of 4.67, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2,5-dibromodec-3-ene is sourced from PubChem (CID 88755062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).