ChemicalBook--->CAS DataBase List--->5273-86-9

5273-86-9

5273-86-9 Structure

5273-86-9 Structure
IdentificationMore
[Name]

BETA-ASARONE
[CAS]

5273-86-9
[Synonyms]

1,2,4-TRIMETHOXY-5-((Z)-1-PROPENYL)BENZENE
ASARONE, B-
B-ASARONE
BETA-ASARONE
BETA-ASARONE (PHENOL DERIVATIVE)
CIS-1-PROPENYL-2,4,5-TRIMETHOXYBENZENE
CIS-2,4,5-TRIMETHOXY-1-PROPENYLBENZENE
CIS-2,4,5-TRIMETHOXYPROPENYLBENZENE
(z)-1,2,4-trimethoxy-5-(1-propenyl)benzene
(Z)-5-Propenyl-1,2,4-trimethoxybenzene
(Z)-Asarone
2,4,5-Trimethoxy-1-propenylbenzene
2,4-trimethoxy-5-(1-propenyl)-(z)-benzen
2,4-trimethoxy-5-propenyl-(z)-benzen
Benzene, 1,2,4-trimethoxy-5-(1-propenyl)-, (Z)-
Benzene, 1,2,4-trimethoxy-5-propenyl-, (Z)-
cis-Asarone
cis-beta-Asarone
cis-Isoasarone
cis-Isoelemicin
[EINECS(EC#)]

226-096-6
[Molecular Formula]

C12H16O3
[MDL Number]

MFCD00009281
[Molecular Weight]

208.25
[MOL File]

5273-86-9.mol
Chemical PropertiesBack Directory
[Appearance]

Crystals. Insoluble in water; soluble in alcohol.
[Boiling point ]

296℃
[density ]

1.073 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.558(lit.)
[Fp ]

>230 °F
[storage temp. ]

-20°C
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Solid
[color ]

Colourless to Pale Yellow
[BRN ]

1910605
[Stability:]

Light Sensitive
[InChI]

1S/C12H16O3/c1-5-6-9-7-11(14-3)12(15-4)8-10(9)13-2/h5-8H,1-4H3/b6-5-
[InChIKey]

RKFAZBXYICVSKP-WAYWQWQTSA-N
[SMILES]

[H]\C(C)=C(/[H])c1cc(OC)c(OC)cc1OC
[LogP]

3.406 (est)
[Uses]

Grain fumigant, insect chemisterilant.
[CAS DataBase Reference]

5273-86-9(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P301+P312+P330
[Hazard Codes ]

Xn
[Risk Statements ]

R22:Harmful if swallowed.
[Safety Statements ]

S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[RTECS ]

DC3000000
[HS Code ]

29093090
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Acute Tox. 4 Oral
[Toxicity]

cyt-hmn-lym 107 mg/L PLMEAA 53,251,87
Hazard InformationBack Directory
[Chemical Properties]

Crystals. Insoluble in water; soluble in alcohol.
[Definition]

ChEBI: The cis-isomer of asarone.
[General Description]

cis-2,4,5-Trimethoxy-1-propenylbenzene is an antibiotic and was isolated from the extract of Acorus gramineus using various chromatographic procedures.
[Safety Profile]

Questionable carcinogen withexperimental carcinogenic data reported. Human mutationdata reported. When heated to decomposition it emitsacrid smoke and irritating vapors.
Spectrum DetailBack Directory
[Spectrum Detail]

BETA-ASARONE(5273-86-9)MS
BETA-ASARONE(5273-86-9)1HNMR
BETA-ASARONE(5273-86-9)13CNMR
BETA-ASARONE(5273-86-9)IR1
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

5273-86-9(sigmaaldrich)
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