5-[(E)-prop-1-enyl]benzo[1,3]dioxole

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Names

[ CAS No. ]:
4043-71-4

[ Name ]:
5-[(E)-prop-1-enyl]benzo[1,3]dioxole

[Synonym ]:
2.6-Dimethyl-3-methylol-heptan
trans-isosafrole
31-Oxy-2.3.6-trimethyl-heptan
2.6-Dimethyl-3-oxymethyl-heptan
4-METHYL-2-ISOPROPYL-1-HEXANOL
2.6-dimethyl-3-oxymethyl-heptane
2-Isopropyl-4-methyl-hexan-1-ol

Chemical & Physical Properties

[ Density]:
1.421g/cm3

[ Boiling Point ]:
253ºC

[ Molecular Formula ]:
C10H10O2

[ Molecular Weight ]:
162.18500

[ Flash Point ]:
77.6ºC

[ Exact Mass ]:
162.06800

[ PSA ]:
18.46000

[ LogP ]:
2.44840

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DA5951000
CHEMICAL NAME :
Benzene, 1,2-(methylenedioxy)-4-propenyl-, (E)-
CAS REGISTRY NUMBER :
4043-71-4
LAST UPDATED :
198402
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H10-O2
MOLECULAR WEIGHT :
162.20

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1280 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
APFRAD Annales Pharmaceutiques Francaises. (SPPIF, B.P.22, F-41353 Vineuil, France) V.1- 1943- Volume(issue)/page/year: 18,601,1960

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Safrole
  • 1-bromopropene
  • 3,4-(METHYLENEDIOXY)PHENYLMAGNESIUM BROMIDE
  • 5-propyl-1,3-benzodioxole
  • ((1R,2R)-1-(benzo[d][1,3]dioxol-5-yl)-1-hydroxypropan-2-yl)diphenylphosphine oxide
  • 1-(3,4-METHYLENEDIOXYPHENYL)-1-PROPANOL
  • METHYLMAGNESIUM BROMIDE
  • 5-(2-methylsulfanylethenyl)-1,3-benzodioxole
  • 1'-acetoxysafrole
  • 1-(1,3-benzodioxol-5-yl)-2-diphenylphosphorylpropan-1-one

DownStream

  • 2-Propenoic acid,3-(1,3-benzodioxol-5-yl)-, ethyl ester
  • Heliotropic acid
  • 5-propyl-1,3-benzodioxole
  • piperonal
  • (+/-)-trans-2-(4-methoxyphenyl)-2,3-dihydro-5-methoxy-3-methylnaphtho[1,2-b]furan
  • 1,4-naphthoquinone
  • Methyl piperonyl ketone
  • 3,4-Methylenedioxyphenyl ethyl ketone
  • 1,3-Benzodioxole,5-(5-methyl-1,3-dioxan-4-yl)-
  • METHYL (E)-3-(1,3-BENZODIOXOL-5-YL)-2-PROPENOATE

Related Compounds

  • eupomatenoid-3
  • (6E)-6-[5-[(E)-prop-1-enyl]benzo[1,2]cyclohepta[3,4-a]pyridin-11-ylidene]hexanoic acid
  • formaldehyde,5-[(E)-prop-1-enyl]-1,3-benzodioxole
  • 5-propan-2-yl-5-[(E)-prop-1-enyl]-1,3-diazinane-2,4,6-trione
  • 5-Butyl-5-(1-propenyl)barbituric acid
  • 2-[(E)-prop-1-enyl]-1,3-dioxolane
  • N-7-Hydroxymethyl Baricitinib
  • 1-(Cyclopropylsulfonyl)-3-[(triethylsilyl)oxy]azetidine
  • 2-(3-(4-(7-((2-(Trimethylsilyl)ethoxy)methyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)azetidin-3-yl)acetonitrile
  • 1-[(1-Methylcyclopropyl)sulfonyl]azetidin-3-ylideneacetonitrile
  • 3-Isoxazol-3-ylcyclobutanol
  • N-(2-Methylallyl)-p-toluidine
  • 5-Fluoro-2-(tetrahydro-2H-thiopyran-4-ylamino)nicotinic acid
  • 3-(2-chlorobenzyl)-2-((4-(2-oxopyrrolidin-1-yl)benzyl)thio)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
  • 1-[(4-methylbenzyl)thio]-4-(3-methylbutyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
  • 1-((2-chloro-6-fluorobenzyl)thio)-4-isobutylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
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