(E)-15-bromopentadec-5-ene

C15H29Br — CID 14309355

IUPAC(E)-15-bromopentadec-5-ene
SMILESCCCC/C=C/CCCCCCCCCBr
InChIInChI=1S/C15H29Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h5-6H,2-4,7-15H2,1H3/b6-5+
InChIKeyAZIRITIZCLFDGA-AATRIKPKSA-N
MW289.30 g/mol
LogP6.25
Rot. Bonds12

About (E)-15-bromopentadec-5-ene

(E)-15-bromopentadec-5-ene (PubChem CID 14309355) has the molecular formula C15H29Br and a molecular weight of 289.30 g/mol. Its IUPAC name is (E)-15-bromopentadec-5-ene.

Molecular Properties

Compound Name(E)-15-bromopentadec-5-ene
PubChem CID14309355
Molecular FormulaC15H29Br
Molecular Weight289.30 g/mol
Exact Mass288.15
IUPAC Name(E)-15-bromopentadec-5-ene
SMILESCCCC/C=C/CCCCCCCCCBr
InChIInChI=1S/C15H29Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h5-6H,2-4,7-15H2,1H3/b6-5+
InChIKeyAZIRITIZCLFDGA-AATRIKPKSA-N
XLogP6.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500289.30
LogP ≤ 56.25
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

(Z)-16-bromohexadec-5-ene
CID 11645149
(Z)-1-bromotetradec-6-ene
CID 58641109
(E)-18-bromooctadec-6-ene
CID 10711567
(5Z,8Z)-17-bromoheptadeca-5,8-diene;ethane
CID 144695117
(E)-1-bromoundec-5-ene
CID 13044969
(5Z,7E)-15-bromopentadeca-5,7-diene
CID 146189436
(5Z,7E)-21-bromohenicosa-5,7-diene
CID 146189402
(6Z,9Z)-18-bromooctadeca-6,9-diene;ethane
CID 143991975
(6Z,9Z)-1-bromopentadeca-6,9-diene
CID 135359087
1,25-dibromopentacos-12-ene
CID 168864699
(7E,9E)-18-bromooctadeca-7,9-diene
CID 14606014
(5Z,8Z)-1-bromotetradeca-5,8-diene
CID 11482688

Frequently Asked Questions

What is the IUPAC name of (E)-15-bromopentadec-5-ene?
The IUPAC name of (E)-15-bromopentadec-5-ene (CID 14309355) is (E)-15-bromopentadec-5-ene.
What is the SMILES notation for (E)-15-bromopentadec-5-ene?
The canonical SMILES for (E)-15-bromopentadec-5-ene is CCCC/C=C/CCCCCCCCCBr.
What is the InChIKey of (E)-15-bromopentadec-5-ene?
The InChIKey is AZIRITIZCLFDGA-AATRIKPKSA-N. The full InChI is InChI=1S/C15H29Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h5-6H,2-4,7-15H2,1H3/b6-5+.
What are the key properties of (E)-15-bromopentadec-5-ene?
(E)-15-bromopentadec-5-ene has a molecular weight of 289.30 g/mol, XLogP of 6.25, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-15-bromopentadec-5-ene is sourced from PubChem (CID 14309355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).