1,3-Bis(allyloxy)benzene

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Basic information

CAS: 13594-95-1
Standard SMILES: C=CCOc1cccc(OCC=C)c1
InChIKey: AZJYGOOYSJQPLJ-UHFFFAOYSA-N
Molecular formula: C12H14O2
Average molar mass: 190.24 g/mol
Monoisotopic mass: 190.09937969

Names & identifiers

Preferred name: 1,3-Bis(allyloxy)benzene
IUPAC: 1,3-bis(prop-2-enoxy)benzene

Names & synonyms

1,3-bis(allyloxy)benzene13594-95-1DTXSID90396025RefChem:218072DTXCID503468841,3-bis(prop-2-enoxy)benzene1,3-bis(prop-2-en-1-yloxy)benzenem-diallyloxybenzeneghl.PD_Mitscher_leg0.144SCHEMBL1520719SCHEMBL3840978SCHEMBL3844869

Show more names

SCHEMBL3846804CHEMBL2271219MFCD00297236AKOS005107332MS-13331,3-Bis[(prop-2-en-1-yl)oxy]benzeneDA-11464

Database identifiers

CAS: 13594-95-1
PubChem CID: 3758903
DTXSID: DTXSID90396025
ChEMBL: CHEMBL2271219
Nikkaji: J1.392.003F

Properties

Computed structural properties

XLogP: 3.6
Topological polar surface area: 18.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 6
Heavy atoms: 14
Formal charge: 0
Complexity: 159

Experimental & physicochemical properties

LogP3.8

Related reactions

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Compound notes

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