(Z)-1-bromo-11-methyltridec-5-ene

C14H27Br — CID 11108579

IUPAC(Z)-1-bromo-11-methyltridec-5-ene
SMILESCCC(C)CCCC/C=C\CCCCBr
InChIInChI=1S/C14H27Br/c1-3-14(2)12-10-8-6-4-5-7-9-11-13-15/h4-5,14H,3,6-13H2,1-2H3/b5-4-
InChIKeyIBQWHOPTKBDUJL-PLNGDYQASA-N
MW275.27 g/mol
LogP5.71
Rot. Bonds10

About (Z)-1-bromo-11-methyltridec-5-ene

(Z)-1-bromo-11-methyltridec-5-ene (PubChem CID 11108579) has the molecular formula C14H27Br and a molecular weight of 275.27 g/mol. Its IUPAC name is (Z)-1-bromo-11-methyltridec-5-ene.

Molecular Properties

Compound Name(Z)-1-bromo-11-methyltridec-5-ene
PubChem CID11108579
Molecular FormulaC14H27Br
Molecular Weight275.27 g/mol
Exact Mass274.13
IUPAC Name(Z)-1-bromo-11-methyltridec-5-ene
SMILESCCC(C)CCCC/C=C\CCCCBr
InChIInChI=1S/C14H27Br/c1-3-14(2)12-10-8-6-4-5-7-9-11-13-15/h4-5,14H,3,6-13H2,1-2H3/b5-4-
InChIKeyIBQWHOPTKBDUJL-PLNGDYQASA-N
XLogP5.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500275.27
LogP ≤ 55.71
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

1-bromo-10-methyldodecane
CID 15569726
(E)-14-methylhexadec-8-enal
CID 6073809
(Z)-16-methyloctadec-10-en-2-amine
CID 170891715
8-methyldec-3-ene
CID 54115614
2,11-dimethyltridec-6-ene
CID 123657363
(E,14R)-1,1-dimethoxy-14-methylhexadec-8-ene
CID 6450378
(Z)-12-methyltetradec-3-enenitrile
CID 139591509
(Z)-1,1-diethoxy-14-methylhexadec-8-ene
CID 20841393
(E,14R)-1,1-diethoxy-14-methylhexadec-8-ene
CID 6450379
(Z)-3-methylheptadec-6-ene
CID 159647190
methyl (Z,14R)-14-methylhexadec-7-enoate
CID 170988097
(E)-1-bromoundec-5-ene
CID 13044969

Frequently Asked Questions

What is the IUPAC name of (Z)-1-bromo-11-methyltridec-5-ene?
The IUPAC name of (Z)-1-bromo-11-methyltridec-5-ene (CID 11108579) is (Z)-1-bromo-11-methyltridec-5-ene.
What is the SMILES notation for (Z)-1-bromo-11-methyltridec-5-ene?
The canonical SMILES for (Z)-1-bromo-11-methyltridec-5-ene is CCC(C)CCCC/C=C\CCCCBr.
What is the InChIKey of (Z)-1-bromo-11-methyltridec-5-ene?
The InChIKey is IBQWHOPTKBDUJL-PLNGDYQASA-N. The full InChI is InChI=1S/C14H27Br/c1-3-14(2)12-10-8-6-4-5-7-9-11-13-15/h4-5,14H,3,6-13H2,1-2H3/b5-4-.
What are the key properties of (Z)-1-bromo-11-methyltridec-5-ene?
(Z)-1-bromo-11-methyltridec-5-ene has a molecular weight of 275.27 g/mol, XLogP of 5.71, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-bromo-11-methyltridec-5-ene is sourced from PubChem (CID 11108579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).