1-prop-1-enoxy-2-prop-2-enoxybenzene

C12H14O2 — CID 57352619

IUPAC1-prop-1-enoxy-2-prop-2-enoxybenzene
SMILESC=CCOc1ccccc1OC=CC
InChIInChI=1S/C12H14O2/c1-3-9-13-11-7-5-6-8-12(11)14-10-4-2/h3-8,10H,1,9H2,2H3
InChIKeyVSSSZJKGRNGBSM-UHFFFAOYSA-N
MW190.24 g/mol
LogP3.16
Rot. Bonds5

About 1-prop-1-enoxy-2-prop-2-enoxybenzene

1-prop-1-enoxy-2-prop-2-enoxybenzene (PubChem CID 57352619) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is 1-prop-1-enoxy-2-prop-2-enoxybenzene.

Molecular Properties

Compound Name1-prop-1-enoxy-2-prop-2-enoxybenzene
PubChem CID57352619
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Name1-prop-1-enoxy-2-prop-2-enoxybenzene
SMILESC=CCOc1ccccc1OC=CC
InChIInChI=1S/C12H14O2/c1-3-9-13-11-7-5-6-8-12(11)14-10-4-2/h3-8,10H,1,9H2,2H3
InChIKeyVSSSZJKGRNGBSM-UHFFFAOYSA-N
XLogP3.16
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-prop-1-enoxy-2-prop-2-enoxybenzene?
The IUPAC name of 1-prop-1-enoxy-2-prop-2-enoxybenzene (CID 57352619) is 1-prop-1-enoxy-2-prop-2-enoxybenzene.
What is the SMILES notation for 1-prop-1-enoxy-2-prop-2-enoxybenzene?
The canonical SMILES for 1-prop-1-enoxy-2-prop-2-enoxybenzene is C=CCOc1ccccc1OC=CC.
What is the InChIKey of 1-prop-1-enoxy-2-prop-2-enoxybenzene?
The InChIKey is VSSSZJKGRNGBSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O2/c1-3-9-13-11-7-5-6-8-12(11)14-10-4-2/h3-8,10H,1,9H2,2H3.
What are the key properties of 1-prop-1-enoxy-2-prop-2-enoxybenzene?
1-prop-1-enoxy-2-prop-2-enoxybenzene has a molecular weight of 190.24 g/mol, XLogP of 3.16, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-prop-1-enoxy-2-prop-2-enoxybenzene is sourced from PubChem (CID 57352619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).