(Z)-anethol

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Names

[ CAS No. ]:
25679-28-1

[ Name ]:
(Z)-anethol

[Synonym ]:
1-(4-Methoxyphenyl)-1-propene
4-piperidin-1-ylmethyl-pyridine
4-Piperidinomethylpyridin
Pyridine,4-(1-piperidinylmethyl)
4-(1-piperidinylmethyl)pyridine
4-(1-propenyl)anisole
(Z)-1-methoxy-4-(prop-1-en-1-yl)benzene
cis-methylchavicol
1-Methoxy-4-(1-propen-1-yl)benzene
1-(4-Pyridylmethyl)-piperidin
4-(piperidinomethyl)pyridine
cis-isoestragole

Chemical & Physical Properties

[ Density]:
0.959g/cm3

[ Boiling Point ]:
237.5ºC at 760mmHg

[ Molecular Formula ]:
C10H12O

[ Molecular Weight ]:
148.20200

[ Flash Point ]:
88.4ºC

[ Exact Mass ]:
148.08900

[ PSA ]:
9.23000

[ LogP ]:
2.72830

[ Vapour Pressure ]:
0.0687mmHg at 25°C

[ Index of Refraction ]:
1.545

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
BZ9100000
CHEMICAL NAME :
Anisole, p-propenyl-, cis-
CAS REGISTRY NUMBER :
25679-28-1
BEILSTEIN REFERENCE NO. :
1209632
LAST UPDATED :
199612
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C10-H12-O
MOLECULAR WEIGHT :
148.22
WISWESSER LINE NOTATION :
2U1R DO1 -C

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Open irritation test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 23,95,1962 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
150 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FAONAU FAO Nutrition Meetings Report Series. (Rome, Italy) No.?-57, 1948-77. Discontinued. Volume(issue)/page/year: 44A,7,1967
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
93 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
THERAP Therapie. (Doin, Editeurs, 8, Place de l'Odeon, F-75006 Paris, France) V.1- 1946- Volume(issue)/page/year: 22,309,1967
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
95 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
COREAF Comptes Rendus Hebdomadaires des Seances, Academie des Sciences. (Paris, France) V.1-261, 1835-1965. For publisher information, see CRASEV. Volume(issue)/page/year: 246,1465,1958 ** OTHER MULTIPLE DOSE TOXICITY DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
16200 mg/kg/90D-C
TOXIC EFFECTS :
Related to Chronic Data - death
REFERENCE :
FAONAU FAO Nutrition Meetings Report Series. (Rome, Italy) No.?-57, 1948-77. Discontinued. Volume(issue)/page/year: 44A,7,1967

Safety Information

[ RIDADR ]:
UN 2811

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1(b)

[ HS Code ]:
2909309090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Estragole
  • Benzene,1-(2-bromoethenyl)-4-methoxy-
  • methyl iodide
  • BENZENE, 1-METHOXY-4-(1-PROPYN-1-YL)-
  • Ethyl(triphenyl)phosphonium bromide
  • 4-Methoxybenzaldehyde
  • ethyl(2-methoxyphenyl)diphenylphosphonium iodide

DownStream

  • anti-(1α,2β,3α,4β)-1,2-bis(4-methoxyphenyl)-3,4-dimethylcyclobutane
  • rac-(1α,2β,3β,4α)-1,2-bis(4-methoxyphenyl)-3,4-dimethylcyclobutane
  • trans-Anethole
  • rac-(1α,2β,3α,4α)-1,2-bis(4-methoxyphenyl)-3,4-dimethylcyclobutane
  • Anethole trithione

Customs

[ HS Code ]: 2909309090

[ Summary ]:
2909309090 other aromatic ethers and their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

Related Compounds

  • (Z)-Desbutyl Lumefantrine
  • (Z)-1-methyl-2-(phenylazo)imidazole
  • (Z)-2-methyl-3-(1-methyl-5-nitro-1H-imidazol-2-yl)prop-2-en-1-ol
  • [(Z)-C-[4-(2,2-dimethylpropanoyl)phenyl]-N-methoxycarbonimidoyl] 4-(2,2-dimethylpropanoyl)benzoate
  • (Z)-3,7-dimethyl-2,6-octadien-4-ol
  • (Z)-2-isopropylbut-2-enedioic acid diethyl ester
  • tert-Butyl N-[2-[[5-methoxy-4-[[4-(1-methylindol-3-yl)pyrimidin-2-yl]amino]-2-nitrophenyl]-methylamino]ethyl]-N-methylcarbamate
  • N-[5-(1H-benzimidazol-2-yl)pentyl]-2-(3-oxo-2,3-dihydro-1H-isoindol-1-yl)acetamide
  • 3-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline
  • 5-Tert-butoxy-2-(dimethylamino)phenol
  • 5-(Cyclohexyloxy)-2-(dimethylamino)phenol
  • 2-[(2,6-Dichlorophenyl)methoxy]-4-methoxybenzaldehyde oxime
  • 4-Methyl-2-(piperidin-3-ylsulfonyl)pyrimidine hydrochloride
  • N-[3-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-2-(4-ethylsulfonylphenyl)acetamide
  • tert-butyl N-[1-(2-hydroxypropyl)cyclobutyl]carbamate
  • (2-Bromo-4-nitrophenyl)-phenylmethanone