(Z)-12-methoxytridec-5-ene

C14H28O — CID 87205093

IUPAC(Z)-12-methoxytridec-5-ene
SMILESCCCC/C=C\CCCCCC(C)OC
InChIInChI=1S/C14H28O/c1-4-5-6-7-8-9-10-11-12-13-14(2)15-3/h7-8,14H,4-6,9-13H2,1-3H3/b8-7-
InChIKeyLDBULRLOVNAGGW-FPLPWBNLSA-N
MW212.38 g/mol
LogP4.72
Rot. Bonds10

About (Z)-12-methoxytridec-5-ene

(Z)-12-methoxytridec-5-ene (PubChem CID 87205093) has the molecular formula C14H28O and a molecular weight of 212.38 g/mol. Its IUPAC name is (Z)-12-methoxytridec-5-ene.

Molecular Properties

Compound Name(Z)-12-methoxytridec-5-ene
PubChem CID87205093
Molecular FormulaC14H28O
Molecular Weight212.38 g/mol
Exact Mass212.21
IUPAC Name(Z)-12-methoxytridec-5-ene
SMILESCCCC/C=C\CCCCCC(C)OC
InChIInChI=1S/C14H28O/c1-4-5-6-7-8-9-10-11-12-13-14(2)15-3/h7-8,14H,4-6,9-13H2,1-3H3/b8-7-
InChIKeyLDBULRLOVNAGGW-FPLPWBNLSA-N
XLogP4.72
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(Z)-14-methoxypentadec-7-ene
CID 87205017
(Z)-19-[(Z)-icos-11-en-2-yl]oxyicos-9-ene
CID 88819107
(Z)-16,16-dimethoxyhexadec-7-ene
CID 6438015
[(Z,2R)-heptadec-12-en-2-yl] methanesulfonate
CID 118938830
(Z)-11-methyldodec-5-ene
CID 159147265
ethane;2-methoxyhexane
CID 91199174
(E)-tridec-8-en-2-ol
CID 173250287
(E)-2-methylheptadec-8-ene
CID 20541049
(Z)-22-methyltricos-9-ene
CID 152752766
(E)-2-methylheptadec-7-ene
CID 173124832
(E)-13-methyltetracos-6-ene
CID 173194183
2-methylhenicos-9-ene
CID 54211724

Frequently Asked Questions

What is the IUPAC name of (Z)-12-methoxytridec-5-ene?
The IUPAC name of (Z)-12-methoxytridec-5-ene (CID 87205093) is (Z)-12-methoxytridec-5-ene.
What is the SMILES notation for (Z)-12-methoxytridec-5-ene?
The canonical SMILES for (Z)-12-methoxytridec-5-ene is CCCC/C=C\CCCCCC(C)OC.
What is the InChIKey of (Z)-12-methoxytridec-5-ene?
The InChIKey is LDBULRLOVNAGGW-FPLPWBNLSA-N. The full InChI is InChI=1S/C14H28O/c1-4-5-6-7-8-9-10-11-12-13-14(2)15-3/h7-8,14H,4-6,9-13H2,1-3H3/b8-7-.
What are the key properties of (Z)-12-methoxytridec-5-ene?
(Z)-12-methoxytridec-5-ene has a molecular weight of 212.38 g/mol, XLogP of 4.72, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-12-methoxytridec-5-ene is sourced from PubChem (CID 87205093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).