(E)-2-bromonon-3-ene

C9H17Br — CID 88753535

IUPAC(E)-2-bromonon-3-ene
SMILESCCCCC/C=C/C(C)Br
InChIInChI=1S/C9H17Br/c1-3-4-5-6-7-8-9(2)10/h7-9H,3-6H2,1-2H3/b8-7+
InChIKeySGKRQBSZEHPDKH-BQYQJAHWSA-N
MW205.14 g/mol
LogP3.91
Rot. Bonds5

About (E)-2-bromonon-3-ene

(E)-2-bromonon-3-ene (PubChem CID 88753535) has the molecular formula C9H17Br and a molecular weight of 205.14 g/mol. Its IUPAC name is (E)-2-bromonon-3-ene.

Molecular Properties

Compound Name(E)-2-bromonon-3-ene
PubChem CID88753535
Molecular FormulaC9H17Br
Molecular Weight205.14 g/mol
Exact Mass204.05
IUPAC Name(E)-2-bromonon-3-ene
SMILESCCCCC/C=C/C(C)Br
InChIInChI=1S/C9H17Br/c1-3-4-5-6-7-8-9(2)10/h7-9H,3-6H2,1-2H3/b8-7+
InChIKeySGKRQBSZEHPDKH-BQYQJAHWSA-N
XLogP3.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.14
LogP ≤ 53.91
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

tetrakis[(E)-hept-1-enyl]phosphanium
CID 118306753
(E)-3-methyldec-4-ene
CID 5364642
(Z,2R)-non-3-en-2-ol
CID 11040800
5-methyldodec-6-ene
CID 86165480
undec-3-en-2-ol
CID 174515693
2-chlorodec-3-ene
CID 71337420
3-methyltetradec-4-ene
CID 123180851
(Z)-2-methyloct-3-ene;octane
CID 159051061
(E,11S)-11-methyltricos-9-ene
CID 163215390
(E)-10-methylheptadec-8-ene
CID 10923034
5-methylpentadec-6-ene
CID 123440014
(E,2S,3S)-3-methylundec-4-en-2-ol
CID 10465011

Frequently Asked Questions

What is the IUPAC name of (E)-2-bromonon-3-ene?
The IUPAC name of (E)-2-bromonon-3-ene (CID 88753535) is (E)-2-bromonon-3-ene.
What is the SMILES notation for (E)-2-bromonon-3-ene?
The canonical SMILES for (E)-2-bromonon-3-ene is CCCCC/C=C/C(C)Br.
What is the InChIKey of (E)-2-bromonon-3-ene?
The InChIKey is SGKRQBSZEHPDKH-BQYQJAHWSA-N. The full InChI is InChI=1S/C9H17Br/c1-3-4-5-6-7-8-9(2)10/h7-9H,3-6H2,1-2H3/b8-7+.
What are the key properties of (E)-2-bromonon-3-ene?
(E)-2-bromonon-3-ene has a molecular weight of 205.14 g/mol, XLogP of 3.91, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-bromonon-3-ene is sourced from PubChem (CID 88753535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).