

Anethole
Catalog No: FT-0600040
CAS No: 104-46-1
- Molecular Formula: 148.20
- Formula Weight: C10H12O
- Inchl Key: RUVINXPYWBROJD-ONEGZZNKSA-N
- Inchl: InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3+
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Product_Name: | cis-Anethol |
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Flash_Point: | 90.6±0.0 °C |
Melting_Point: | 20-21 °C(lit.) |
FW: | 148.202 |
Density: | 1.0±0.1 g/cm3 |
CAS: | 104-46-1 |
Bolling_Point: | 237.5±9.0 °C at 760 mmHg |
MF: | C10H12O |
Molecular_Structure: | ['1 . Molar refractive index 4882 ', '2 . Molar volume 1544 ', '3 . Parachor (902K)3669 ', '4 . Surface tension 318 ', '5 . Dielectric constant ', '6 偶极距(10-24cm3) ', '7 . Polarizability 1935'] |
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Flash_Point: | 90.6±0.0 °C |
Refractive_Index: | 1.545 |
FW: | 148.202 |
Density: | 1.0±0.1 g/cm3 |
Bolling_Point: | 237.5±9.0 °C at 760 mmHg |
Computational_Chemistry: | ['1 . XlogP 33 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 1 ', '4 . Rotatable Bond Count 2 ', '5 . Isotope Atom Count ', '6 . TPSA 92 ', '7 . Heavy Atom Count 11 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 121 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 0 ', '12. Undefined Atom Stereocenter Count 0 ', '13. Defined Bond Stereocenter Count 1 ', '14. Undefined Bond Stereocenter Count 0 ', '15. Covalently-Bonded Unit Count 1'] |
LogP: | 3.17 |
Melting_Point: | 20-21 °C(lit.) |
PSA: | 9.23000 |
MF: | C10H12O |
More_Info: | ['1 . Appearance 反式为结晶体,顺式为Liquid 。有甜润的茴香香气。 ', '2 . Density(g/mL,20℃)09883 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)225 ', '5 . Boiling point(ºC,Atmospheric pressure)235 ', '6 . Boiling point(ºC, 307pa)81~815 ', '7 . Refractive index156145 ', '8 . Flash point(ºC)90 ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC): Unknow ', '11 . Vapor pressure(mmHg,ºC)Unknow ', '12 . Saturated vapor pressure(kPa, ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(KPa)Unknow ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility 能与氯仿醚混溶,Soluble in 苯乙酸乙酯丙酮二硫化碳石油醚and 醇,Insoluble in Water 。'] |
Vapor_Pressure: | 0.1±0.5 mmHg at 25°C |
Exact_Mass: | 148.088821 |
Hazard_Codes: | Xi: Irritant; |
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RTECS: | BZ9275000 |
Risk_Statements(EU): | R43 |
HS_Code: | 2909309090 |
WGK_Germany: | 2 |
Safety_Statements: | S36/37 |
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