CAS 493-09-4|1,2-乙烯基二氧苯|Benzo-1,4-dioxane|1,2-Ethylenedioxybenzene|1,4-苯并二噁烷|1,4-benzodioxan|2,3-dihydro-1,4-benzodioxine|2,3-Dihydro-1,4-benzodioxin|1,4-Benzodioxan|1,4-苯并二氧六环|2,3-...

Molecular Formula

C₈H₈O₂

Molecular Mass

136.14792

Exact Mass

136.0524295

InChI

InChI=1S/C8H8O2/c1-2-4-8-7(3-1)9-5-6-10-8/h1-4H,5-6H2

InChIKey

BNBQRQQYDMDJAH-UHFFFAOYSA-N

Canonic Smiles

C1COc2c(O1)cccc2

Isomeric Smiles

O1c2ccccc2OCC1

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

1.4863783

LogD (pH = 7.4)

1.4863783

Log P

1.4863783

Molar Refractivity

37.0154

Polarizability

14.634083

Polar Surface Area

18.46

Rotatable Bonds

Lipinski's Rule of Five

true

Academic Data

PubChem

10301

Synonyms

1,4-苯并二噁烷1,2-乙烯基二氧苯Benzo-1,4-dioxane1,2-Ethylenedioxybenzene1,4-苯并二氧六环1,4-Benzodioxan2,3-Dihydro-1,4-benzodioxin2,3-Dihydrobenzo[b][1,4]dioxine1,2-(Ethylenedioxy)benzene1,4-Benzodioxane2,3-Dihydro-1,4-benzodioxine1,4-Benzodioxane

IUPAC name

2,3-dihydro-1,4-benzodioxine

IUPAC Traditional name

1,4-benzodioxan