α-Terpinyl acetate structure
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Common Name | α-Terpinyl acetate | ||
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CAS Number | 80-26-2 | Molecular Weight | 196.286 | |
Density | 1.0±0.1 g/cm3 | Boiling Point | 239.9±9.0 °C at 760 mmHg | |
Molecular Formula | C12H20O2 | Melting Point | 220 °C | |
MSDS | Chinese USA | Flash Point | 83.0±17.1 °C | |
Symbol |
GHS07 |
Signal Word | Warning |
Use of α-Terpinyl acetateα-Terpinyl acetate is a monoterpene ester isolated from Laurus nobilis L. essential oil. α-Terpinyl acetate is a competitive P450 2B6 substrate which binding to the active site of P450 2B6 with a Kd value of 5.4 μM[1][2]. |
Name | Terpinyl Acetate |
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Synonym | More Synonyms |
Description | α-Terpinyl acetate is a monoterpene ester isolated from Laurus nobilis L. essential oil. α-Terpinyl acetate is a competitive P450 2B6 substrate which binding to the active site of P450 2B6 with a Kd value of 5.4 μM[1][2]. |
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Related Catalog | |
Target |
CYP2B6:5.4 μM (Kd) |
In Vitro | The bupropion hydroxylation activity of P450 2B6 is inhibited by α-Terpinyl acetate wiht an IC50 value of 10.4 μM and α-Terpinyl acetate is determined to be a competitive inhibitor of P450 2B6 with a Ki of 7.6 μM[2]. |
References |
Density | 1.0±0.1 g/cm3 |
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Boiling Point | 239.9±9.0 °C at 760 mmHg |
Melting Point | 220 °C |
Molecular Formula | C12H20O2 |
Molecular Weight | 196.286 |
Flash Point | 83.0±17.1 °C |
Exact Mass | 196.146332 |
PSA | 26.30000 |
LogP | 3.67 |
Vapour Pressure | 0.0±0.5 mmHg at 25°C |
Index of Refraction | 1.467 |
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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Symbol |
GHS07 |
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Signal Word | Warning |
Hazard Statements | H315-H319 |
Precautionary Statements | P305 + P351 + P338 |
Personal Protective Equipment | Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
Hazard Codes | Xi |
Risk Phrases | R36/38 |
Safety Phrases | S26-S36 |
RIDADR | NONH for all modes of transport |
WGK Germany | 2 |
RTECS | OT0200000 |
HS Code | 2915390090 |
HS Code | 2915390090 |
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Summary | 2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:5.5%. General tariff:30.0% |
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MFCD00037155 |
a-terpinyl acetate, (±) |
(±)-α-Terpineol acetate |
EINECS 201-265-7 |
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1-Methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl acetate |
L6UTJ A1 DX1&1&OV1 |
Terpinyl acetate |
(±)-a-Terpinyl acetate |
p-Menth-1-en-8-ol, acetate |