105-91-9

• 常用中文名：(Z)-3,7-二甲基-2,6-亚辛基-1-醇丙酸酯
• 常用英文名：neryl propionate
• CAS号：105-91-9
• 分子式：C₁₃H₂₂O₂
• 分子量：210.31300
• 发布时间：2018-10-08 16:42:16
• 更新时间：2025-08-26 10:00:28

名称

• 中文名: (Z)-3,7-二甲基-2,6-亚辛基-1-醇丙酸酯
• 英文名: neryl propionate
• 英文别名: Neryl ester; nerol acetate; neryl-propionate; NERYL ACETATE; cis-geranyl acetate; Nerylacetat; NERYL ACETATE C; EINECS 203-345-7; Neryl-propionat; Neryl propanoate; NERYL ACETATE A; neril acetate

物化性质

• 密度: 0.9 g/cm3
• 沸点: 282.4ºC at 760 mmHg
• 分子式: C₁₃H₂₂O₂
• 分子量: 210.31300
• 闪点: 97.7ºC
• 精确质量: 210.16200
• PSA: 26.30000
• LogP: 3.63230
• 外观性状: 无色液体
• 蒸汽压: 0.00336mmHg at 25°C
• 折射率: 1.459
• 分子结构:

  1、 摩尔折射率：63.85

  2、 摩尔体积（cm³/mol）：233.4

  3、 等张比容（90.2K）：540.8

  4、 表面张力（dyne/cm）：28.8

  5、 极化率（10-24cm3）：25.31

毒性和生态

毒理学数据: LD50＞5g/kg(大鼠，口授)。 CHEMICAL IDENTIFICATION RTECS NUMBER : RG5927910 CHEMICAL NAME : 2,6-Octadien-1-ol, 3,7-dimethyl-, propionate, (Z)- CAS REGISTRY NUMBER : 105-91-9 LAST UPDATED : 199709 DATA ITEMS CITED : 4 MOLECULAR FORMULA : C13-H22-O2 MOLECULAR WEIGHT : 210.35 WISWESSER LINE NOTATION : 2VO2UY1&3UY1&1 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : Standard Draize test ROUTE OF EXPOSURE : Administration onto the skin SPECIES OBSERVED : Rodent - rabbit REFERENCE : FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,629,1976 ** ACUTE TOXICITY DATA ** TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - rat DOSE/DURATION : >5 gm/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,629,1976 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Administration onto the skin SPECIES OBSERVED : Rodent - rabbit DOSE/DURATION : >5 gm/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,629,1976

安全

• 海关编码: 2915509000

合成路线

123-35-3 802294-64-0 ~% 105-90-8 105-91-9

文献：LOYOLA UNIVERSITY OF CHICAGO Patent: WO2005/44774 A1, 2005 ; Location in patent: Page/Page column 15-16 ;

106-25-2 79-03-8 ~91% 105-91-9

文献：Novak, Lajos; Poppe, Laszlo; Kis-Tamas, Attila; Szantay, Csaba Acta Chimica Hungarica, 1985 , vol. 118, # 1 p. 17 - 24

106-25-2 802294-64-0 ~99% 105-91-9

文献：Lozano, Pedro; Bernal, Juana M.; Navarro, Alicia Green Chemistry, 2012 , vol. 14, # 11 p. 3026 - 3033

87081-71-8 ~% 105-91-9 73214-62-7

文献：Novak, Lajos; Poppe, Laszlo; Kis-Tamas, Attila; Szantay, Csaba Acta Chimica Hungarica, 1985 , vol. 118, # 1 p. 17 - 24

57745-83-2 ~% 105-91-9

文献：Novak, Lajos; Poppe, Laszlo; Kis-Tamas, Attila; Szantay, Csaba Acta Chimica Hungarica, 1985 , vol. 118, # 1 p. 17 - 24

87081-70-7 ~% 105-91-9

文献：Novak, Lajos; Poppe, Laszlo; Kis-Tamas, Attila; Szantay, Csaba Acta Chimica Hungarica, 1985 , vol. 118, # 1 p. 17 - 24

上下游产品

上游产品  6
123-35-3 106-25-2 79-03-8 87081-71-8
57745-83-2 87081-70-7
下游产品  2
87081-70-7 57745-83-2

海关

海关编码	2915509000
中文概述	2915509000 丙酸盐和酯. 增值税率:17.0% 退税率:9.0% 监管条件:AB(入境货物通关单,出境货物通关单) 最惠国关税:5.5% 普通关税:30.0%
申报要素	品名, 成分含量, 用途
监管条件	A.入境货物通关单 B.出境货物通关单
检验检疫	R.进口食品卫生监督检验 S.出口食品卫生监督检验 M.进口商品检验 N.出口商品检验
Summary	2915509000 propionic acid, its salts and esters。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:5.5%。general tariff:30.0%