2-(2-but-2-en-2-yloxyethoxy)but-2-ene

C10H18O2 — CID 91164778

IUPAC2-(2-but-2-en-2-yloxyethoxy)but-2-ene
SMILESCC=C(C)OCCOC(C)=CC
InChIInChI=1S/C10H18O2/c1-5-9(3)11-7-8-12-10(4)6-2/h5-6H,7-8H2,1-4H3
InChIKeyAZSUAUCSZWNZDB-UHFFFAOYSA-N
MW170.25 g/mol
LogP2.87
Rot. Bonds5

About 2-(2-but-2-en-2-yloxyethoxy)but-2-ene

2-(2-but-2-en-2-yloxyethoxy)but-2-ene (PubChem CID 91164778) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 2-(2-but-2-en-2-yloxyethoxy)but-2-ene.

Molecular Properties

Compound Name2-(2-but-2-en-2-yloxyethoxy)but-2-ene
PubChem CID91164778
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name2-(2-but-2-en-2-yloxyethoxy)but-2-ene
SMILESCC=C(C)OCCOC(C)=CC
InChIInChI=1S/C10H18O2/c1-5-9(3)11-7-8-12-10(4)6-2/h5-6H,7-8H2,1-4H3
InChIKeyAZSUAUCSZWNZDB-UHFFFAOYSA-N
XLogP2.87
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 2-(2-but-2-en-2-yloxyethoxy)but-2-ene?
The IUPAC name of 2-(2-but-2-en-2-yloxyethoxy)but-2-ene (CID 91164778) is 2-(2-but-2-en-2-yloxyethoxy)but-2-ene.
What is the SMILES notation for 2-(2-but-2-en-2-yloxyethoxy)but-2-ene?
The canonical SMILES for 2-(2-but-2-en-2-yloxyethoxy)but-2-ene is CC=C(C)OCCOC(C)=CC.
What is the InChIKey of 2-(2-but-2-en-2-yloxyethoxy)but-2-ene?
The InChIKey is AZSUAUCSZWNZDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-5-9(3)11-7-8-12-10(4)6-2/h5-6H,7-8H2,1-4H3.
What are the key properties of 2-(2-but-2-en-2-yloxyethoxy)but-2-ene?
2-(2-but-2-en-2-yloxyethoxy)but-2-ene has a molecular weight of 170.25 g/mol, XLogP of 2.87, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-but-2-en-2-yloxyethoxy)but-2-ene is sourced from PubChem (CID 91164778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).