S9652

Safrole

≥97%

• 동의어(들): 4-Allyl-1,2-methylenedioxybenzene, 5-Allyl-1,3-benzodioxole
• 실험식(Hill 표기법): C₁₀H₁₀O₂
• CAS Number: 94-59-7
• Molecular Weight: 162.19
• Beilstein: 136380
• EC Number: 202-345-4
• MDL number: MFCD00005841
• UNSPSC 코드: 12352200
• PubChem Substance ID: 24899851
• NACRES: NA.25

속성

• vapor pressure: 1 mmHg ( 63.8 °C)
• Quality Level: 200
• 분석: ≥97%
• 색상: yellow
• refractive index: n20/D 1.537 (lit.)
• bp: 232-234 °C (lit.)
• mp: 11.2 °C (lit.)
• density: 1.095 g/mL at 25 °C (lit.)
• 응용 분야: metabolomics; vitamins, nutraceuticals, and natural products
• SMILES string: 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
• InChI key: ZMQAAUBTXCXRIC-UHFFFAOYSA-N

설명

일반 설명

Safrole is used as a counter irritant and for treating parasitic infections.

애플리케이션

Safrole has been used to investigate the role of aldehyde dehydrogenase 3A1 (ALDH3A1) in conferring cisplatin resistance to head and neck squamous cell carcinoma (HNSCC).

생화학적/생리학적 작용

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.

Safrole is one of the vital food‐borne phytotoxins. It is present in various natural products such as spices including anise, basil, nutmeg and pepper. It exhibits cytotoxic effect in human tongue squamous carcinoma SCC‐4 cells by promoting apoptosis via mitochondria‐ and caspase‐dependent signal pathways.

기타 정보

Principal constituent of sassafras oil

안전성 정보

• 픽토그램: GHS08,GHS07
• 신호어: Danger
• 유해 및 위험 성명서: H302,H315,H341,H350
• 예방조치 성명서: P202 - P264 - P280 - P301 + P312 - P302 + P352 - P308 + P313
• Hazard Classifications: Acute Tox. 4 Oral - Carc. 1B - Muta. 2 - Skin Irrit. 2
• Storage Class Code: 6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
• WGK: WGK 3
• Flash Point (°F): 212.0 °F - closed cup
• Flash Point (°C): 100 °C - closed cup
• 개인 보호 장비: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter