(E)-1-methoxypentadec-1-ene

C16H32O — CID 13215972

IUPAC(E)-1-methoxypentadec-1-ene
SMILESCCCCCCCCCCCCC/C=C/OC
InChIInChI=1S/C16H32O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-2/h15-16H,3-14H2,1-2H3/b16-15+
InChIKeyQJNJOECOYRLQHZ-FOCLMDBBSA-N
MW240.43 g/mol
LogP5.85
Rot. Bonds13

About (E)-1-methoxypentadec-1-ene

(E)-1-methoxypentadec-1-ene (PubChem CID 13215972) has the molecular formula C16H32O and a molecular weight of 240.43 g/mol. Its IUPAC name is (E)-1-methoxypentadec-1-ene.

Molecular Properties

Compound Name(E)-1-methoxypentadec-1-ene
PubChem CID13215972
Molecular FormulaC16H32O
Molecular Weight240.43 g/mol
Exact Mass240.25
IUPAC Name(E)-1-methoxypentadec-1-ene
SMILESCCCCCCCCCCCCC/C=C/OC
InChIInChI=1S/C16H32O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-2/h15-16H,3-14H2,1-2H3/b16-15+
InChIKeyQJNJOECOYRLQHZ-FOCLMDBBSA-N
XLogP5.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.43
LogP ≤ 55.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-1-methoxypentadec-1-ene?
The IUPAC name of (E)-1-methoxypentadec-1-ene (CID 13215972) is (E)-1-methoxypentadec-1-ene.
What is the SMILES notation for (E)-1-methoxypentadec-1-ene?
The canonical SMILES for (E)-1-methoxypentadec-1-ene is CCCCCCCCCCCCC/C=C/OC.
What is the InChIKey of (E)-1-methoxypentadec-1-ene?
The InChIKey is QJNJOECOYRLQHZ-FOCLMDBBSA-N. The full InChI is InChI=1S/C16H32O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-2/h15-16H,3-14H2,1-2H3/b16-15+.
What are the key properties of (E)-1-methoxypentadec-1-ene?
(E)-1-methoxypentadec-1-ene has a molecular weight of 240.43 g/mol, XLogP of 5.85, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-methoxypentadec-1-ene is sourced from PubChem (CID 13215972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).