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08010

Supelco

Safrole

certified reference material, TraceCERT®, Manufactured by: Sigma-Aldrich Production GmbH, Switzerland

Sinónimos:

4-Allyl-1,2-methylenedioxybenzene, 5-Allyl-1,3-benzodioxole

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About This Item

Fórmula empírica (notación de Hill):
C10H10O2
Número de CAS:
94-59-7
Peso molecular:
162.19
Beilstein:
136380
Número CE:
202-345-4
Número MDL:
MFCD00005841
Código UNSPSC:
41116107
ID de la sustancia en PubChem:
329748537
NACRES:
NA.24

grado

certified reference material
TraceCERT®

Nivel de calidad

300

presión de vapor

1 mmHg ( 63.8 °C)

Línea del producto

TraceCERT®

fabricante / nombre comercial

Manufactured by: Sigma-Aldrich Production GmbH, Switzerland

técnicas

gas chromatography (GC): suitable

índice de refracción

n20/D 1.537 (lit.)

bp

232-234 °C (lit.)

mp

11.2 °C (lit.)

densidad

1.095 g/mL at 25 °C (lit.)

aplicaciones

cleaning products
cosmetics
food and beverages
personal care

Formato

neat

temp. de almacenamiento

2-8°C

cadena SMILES

C=CCc1ccc2OCOc2c1

InChI

1S/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2,4-6H,1,3,7H2

Clave InChI

ZMQAAUBTXCXRIC-UHFFFAOYSA-N

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Descripción general

This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to primary material from an NMI, e.g. NIST or NMIJ.
Certified content by quantitative NMR incl. uncertainty and expiry date are given on the certificate.
Download your certificate at: http://www.sigma-aldrich.com.

Acciones bioquímicas o fisiológicas

Safrole is a naturally-occurring genotoxic compound found in Sassafras root and Areca (betel) quid. It is a hepatocarcinogen, and safrole-DNA adducts have also been seen in oral cancers of Areca users. Metabolites of safrole form adducts with DNA and induce chromasomal aberrations and sister chromatid exchanges.

Envase

Bottomless glass bottle. Contents are inside inserted fused cone.

Otras notas

Principal constituent of sassafras oil

Información legal

TraceCERT is a registered trademark of Merck KGaA, Darmstadt, Germany

Pictogramas

Health hazardExclamation mark
GHS08,GHS07

Palabra de señalización

Danger

Frases de peligro

H302,H315,H341,H350

Clasificaciones de peligro

Acute Tox. 4 Oral - Carc. 1B - Muta. 2 - Skin Irrit. 2

Código de clase de almacenamiento

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

Clase de riesgo para el agua (WGK)

WGK 3

Punto de inflamabilidad (°F)

212.0 °F - closed cup

Punto de inflamabilidad (°C)

100 °C - closed cup

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Certificados de análisis (COA)

Lot/Batch Number

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Chia-Jung Lee et al.
Molecules (Basel, Switzerland), 25(19) (2020-10-11)
Acne is a common skin condition observed in adolescents. Nutmeg (Myristica fragrans Houtt) (MF) is a well-known traditional Chinese medicine; its major toxic components, safrole and myristicin, are rich in essential oils. Essential oils of MF (MFO) were extracted by
Héctor Carrasco et al.
Molecules (Basel, Switzerland), 17(1), 1002-1024 (2012-01-21)
Twenty one phenylpropanoids (including eugenol and safrole) and synthetic analogues, thirteen of them new compounds, were evaluated for antifungal properties, first with non-targeted assays against a panel of human opportunistic pathogenic fungi. Some structure-activity relationships could be observed, mainly related
Li-Ching Shen et al.
Toxicology letters, 213(3), 309-315 (2012-07-24)
Safrole, a naturally occurring product derived from spices and herbs, has been shown to be associated with the development of hepatocellular carcinoma in rodents. Safrole 2',3'-oxide (SFO), an electrophilic metabolite of safrole, was shown to react with DNA bases to
Le Su et al.
Toxicology letters, 217(2), 129-136 (2012-12-29)
Safrole-2',3'-oxide (SFO) is the major electrophilic metabolite of safrole (4-allyl-1, 2-methylenedioxybenzene), a natural plant constituent found in essential oils of numerous edible herbs and spices and in food containing these herbs, such as pesto sauce, cola beverages and bologna sausages.
Su-ying Hu et al.
Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials, 35(2), 188-194 (2012-07-25)
To analyze the genetic diversity and the volatile components of Asarum sieboldii from seven habitats in Qin-ba region. The genetic diversity of the herb was analyzed by ISSR (inter simple sequence repeat) markers; The relative content volatile components of the
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