基本信息
线性分子式 | CH3CH2CH(CH3)COOCH3 |
分子量 | 116.16 |
FEMA编号 | 2719 |
Beilstein | 1720409 |
EC 号 | 212-778-0 |
欧洲委员会编号 | 2085c |
MDL编号 | MFCD00009335 |
PubChem化学物质编号 | 24901285 |
Flavis编号 | 9.483 |
NACRES | NA.21 |
产品性质
质量水平 | 400 |
等级 | FG Halal Kosher natural |
agency | follows IFRA guidelines meets purity specifications of JECFA |
reg. compliance | EU Regulation 1223/2009 EU Regulation 1334/2008 & 178/2002 FCC FDA 21 CFR 172.515 |
测定 | ≥98% |
折射率 | n |
bp | 115 ℃ (lit.) |
密度 | 0.88 g/mL at 25 ℃ (lit.) |
文件 | see Safety & Documentation for available documents |
性状检查 | ethereal; fruity |
application(s) | flavors and fragrances |
食品过敏原 | no known allergens |
致敏芳香化合物 | no known allergens |
SMILES string | CCC(C)C(=O)OC |
InChI | 1S/C6H12O2/c1-4-5(2)6(7)8-3/h5H,4H2,1-3H3 |
InChI key | OCWLYWIFNDCWRZ-UHFFFAOYSA-N |
安全信息
象形图 | |
警示用语: | Warning |
危险声明 | H226 |
预防措施声明 | P210 - P233 - P303 + P361 + P353 - P370 + P378 - P403 + P235 - P501 |
危险分类 | Flam. Liq. 3 |
储存分类代码 | 3 - Flammable liquids |
WGK | WGK 2 |
闪点(F) | 89.6 °F - closed cup |
闪点(C) | 32 ℃ - closed cup |
个人防护装备 | Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter |
Sigma-Aldrich