2-bromotetradec-1-ene

C14H27Br — CID 2757183

IUPAC2-bromotetradec-1-ene
SMILESC=C(Br)CCCCCCCCCCCC
InChIInChI=1S/C14H27Br/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h2-13H2,1H3
InChIKeyZGHJASFANHZLFH-UHFFFAOYSA-N
MW275.27 g/mol
LogP6.21
Rot. Bonds11

About 2-bromotetradec-1-ene

2-bromotetradec-1-ene (PubChem CID 2757183) has the molecular formula C14H27Br and a molecular weight of 275.27 g/mol. Its IUPAC name is 2-bromotetradec-1-ene.

Molecular Properties

Compound Name2-bromotetradec-1-ene
PubChem CID2757183
Molecular FormulaC14H27Br
Molecular Weight275.27 g/mol
Exact Mass274.13
IUPAC Name2-bromotetradec-1-ene
SMILESC=C(Br)CCCCCCCCCCCC
InChIInChI=1S/C14H27Br/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h2-13H2,1H3
InChIKeyZGHJASFANHZLFH-UHFFFAOYSA-N
XLogP6.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500275.27
LogP ≤ 56.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

6-methylidenedodecane
CID 21453027
henicos-1-en-2-ol
CID 90735098
6-methylidenetetradecane
CID 21477883
2-methylidenepentadecan-1-ol
CID 10847661
19-methylideneheptatriacontane;titanium
CID 174477367
2-methyltetradec-1-ene
CID 521375
hexadecanoyl bromide
CID 10041615
ethene;tridecan-7-one
CID 159715360
4-methylidenenonadecane
CID 139983203
4-methylidenetricosane
CID 139983205
ethane;2-methyloct-1-ene
CID 143077596
3-methylidenedecane
CID 21453024

Frequently Asked Questions

What is the IUPAC name of 2-bromotetradec-1-ene?
The IUPAC name of 2-bromotetradec-1-ene (CID 2757183) is 2-bromotetradec-1-ene.
What is the SMILES notation for 2-bromotetradec-1-ene?
The canonical SMILES for 2-bromotetradec-1-ene is C=C(Br)CCCCCCCCCCCC.
What is the InChIKey of 2-bromotetradec-1-ene?
The InChIKey is ZGHJASFANHZLFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27Br/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h2-13H2,1H3.
What are the key properties of 2-bromotetradec-1-ene?
2-bromotetradec-1-ene has a molecular weight of 275.27 g/mol, XLogP of 6.21, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromotetradec-1-ene is sourced from PubChem (CID 2757183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).