1,2-bis(2-methylprop-2-enoxy)benzene

C14H18O2 — CID 10878622

IUPAC1,2-bis(2-methylprop-2-enoxy)benzene
SMILESC=C(C)COc1ccccc1OCC(=C)C
InChIInChI=1S/C14H18O2/c1-11(2)9-15-13-7-5-6-8-14(13)16-10-12(3)4/h5-8H,1,3,9-10H2,2,4H3
InChIKeyWKKRVARGMNGLFM-UHFFFAOYSA-N
MW218.30 g/mol
LogP3.60
Rot. Bonds6

About 1,2-bis(2-methylprop-2-enoxy)benzene

1,2-bis(2-methylprop-2-enoxy)benzene (PubChem CID 10878622) has the molecular formula C14H18O2 and a molecular weight of 218.30 g/mol. Its IUPAC name is 1,2-bis(2-methylprop-2-enoxy)benzene.

Molecular Properties

Compound Name1,2-bis(2-methylprop-2-enoxy)benzene
PubChem CID10878622
Molecular FormulaC14H18O2
Molecular Weight218.30 g/mol
Exact Mass218.13
IUPAC Name1,2-bis(2-methylprop-2-enoxy)benzene
SMILESC=C(C)COc1ccccc1OCC(=C)C
InChIInChI=1S/C14H18O2/c1-11(2)9-15-13-7-5-6-8-14(13)16-10-12(3)4/h5-8H,1,3,9-10H2,2,4H3
InChIKeyWKKRVARGMNGLFM-UHFFFAOYSA-N
XLogP3.60
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-methyl-2-(2-methylprop-2-enoxy)benzene
CID 4157656
1-(2-methylprop-2-enoxy)-2-phenylbenzene
CID 70267118
1,2-bis(2-methylprop-2-enoxy)naphthalene
CID 139631746
1-ethynyl-2-(2-methylprop-2-enoxy)benzene
CID 11789677
2-[[2-(2-methylprop-2-enoxy)phenoxy]methyl]oxirane
CID 13171806
2-[2-(2-methylprop-2-enoxy)phenyl]propan-2-amine
CID 117294143
N-[[2-(2-methylprop-2-enoxy)phenyl]methyl]ethanamine
CID 54849925
2-fluoro-1-methyl-3-(2-methylprop-2-enoxy)benzene
CID 103988421
N-methoxy-1-[2-(2-methylprop-2-enoxy)phenyl]methanamine
CID 117296323
(1S)-1-[2-(2-methylprop-2-enoxy)phenyl]propan-1-amine
CID 78933036
N-[[2-(2-methylprop-2-enoxy)phenyl]methyl]propan-2-amine
CID 54850060
(1R)-1-[2-(2-methylprop-2-enoxy)phenyl]propan-1-amine
CID 63366086

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(2-methylprop-2-enoxy)benzene?
The IUPAC name of 1,2-bis(2-methylprop-2-enoxy)benzene (CID 10878622) is 1,2-bis(2-methylprop-2-enoxy)benzene.
What is the SMILES notation for 1,2-bis(2-methylprop-2-enoxy)benzene?
The canonical SMILES for 1,2-bis(2-methylprop-2-enoxy)benzene is C=C(C)COc1ccccc1OCC(=C)C.
What is the InChIKey of 1,2-bis(2-methylprop-2-enoxy)benzene?
The InChIKey is WKKRVARGMNGLFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O2/c1-11(2)9-15-13-7-5-6-8-14(13)16-10-12(3)4/h5-8H,1,3,9-10H2,2,4H3.
What are the key properties of 1,2-bis(2-methylprop-2-enoxy)benzene?
1,2-bis(2-methylprop-2-enoxy)benzene has a molecular weight of 218.30 g/mol, XLogP of 3.60, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(2-methylprop-2-enoxy)benzene is sourced from PubChem (CID 10878622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).