(E)-1-methoxydec-2-en-4,6,8-triyne

C11H10O — CID 139584845

IUPAC(E)-1-methoxydec-2-en-4,6,8-triyne
SMILESCC#CC#CC#C/C=C/COC
InChIInChI=1S/C11H10O/c1-3-4-5-6-7-8-9-10-11-12-2/h9-10H,11H2,1-2H3/b10-9+
InChIKeyPZLZEXRSLQTBJE-MDZDMXLPSA-N
MW158.20 g/mol
LogP1.22
Rot. Bonds2

About (E)-1-methoxydec-2-en-4,6,8-triyne

(E)-1-methoxydec-2-en-4,6,8-triyne (PubChem CID 139584845) has the molecular formula C11H10O and a molecular weight of 158.20 g/mol. Its IUPAC name is (E)-1-methoxydec-2-en-4,6,8-triyne.

Molecular Properties

Compound Name(E)-1-methoxydec-2-en-4,6,8-triyne
PubChem CID139584845
Molecular FormulaC11H10O
Molecular Weight158.20 g/mol
Exact Mass158.07
IUPAC Name(E)-1-methoxydec-2-en-4,6,8-triyne
SMILESCC#CC#CC#C/C=C/COC
InChIInChI=1S/C11H10O/c1-3-4-5-6-7-8-9-10-11-12-2/h9-10H,11H2,1-2H3/b10-9+
InChIKeyPZLZEXRSLQTBJE-MDZDMXLPSA-N
XLogP1.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(Z)-1,4-dimethoxybut-2-ene
CID 5386697
Trans-1,4-dimethoxy-2-butene
CID 5362882
1-Methoxydec-2-en-4,6,8-triyne
CID 162946868
2-Butene, 1-methoxy-, (E)-
CID 5366216
2-Butyne, 1-(2-propenyloxy)-
CID 11147683
(E)-1-[(E)-but-2-enoxy]but-2-ene
CID 14533154
Crotyl ether
CID 53823046
2-Butenyl ethyl ether
CID 5358345
1-But-3-ynoxyhexa-2,4-diene
CID 86197565
(E)-1-prop-2-ynoxybut-2-ene
CID 12749729
(E)-1,4-bis(prop-2-ynoxy)but-2-ene
CID 102258477
Ethoxybut-2-ene
CID 316613

Frequently Asked Questions

What is the IUPAC name of (E)-1-methoxydec-2-en-4,6,8-triyne?
The IUPAC name of (E)-1-methoxydec-2-en-4,6,8-triyne (CID 139584845) is (E)-1-methoxydec-2-en-4,6,8-triyne.
What is the SMILES notation for (E)-1-methoxydec-2-en-4,6,8-triyne?
The canonical SMILES for (E)-1-methoxydec-2-en-4,6,8-triyne is CC#CC#CC#C/C=C/COC.
What is the InChIKey of (E)-1-methoxydec-2-en-4,6,8-triyne?
The InChIKey is PZLZEXRSLQTBJE-MDZDMXLPSA-N. The full InChI is InChI=1S/C11H10O/c1-3-4-5-6-7-8-9-10-11-12-2/h9-10H,11H2,1-2H3/b10-9+.
What are the key properties of (E)-1-methoxydec-2-en-4,6,8-triyne?
(E)-1-methoxydec-2-en-4,6,8-triyne has a molecular weight of 158.20 g/mol, XLogP of 1.22, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-methoxydec-2-en-4,6,8-triyne is sourced from PubChem (CID 139584845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).