データを補完しています。通常は 1 分以内に完了します
基本情報
- CAS
687-47-8- 標準SMILES
CCOC(=O)[C@H](C)O- InChIKey
LZCLXQDLBQLTDK-BYPYZUCNSA-N- 分子式
- C5H10O3
- 平均分子量
- 118.13 g/mol
- 単同位体質量
- 118.06299418
概要
Ethyl (2S)-lactate is the (2S)-enantiomer of ethyl lactate. It has a role as a Saccharomyces cerevisiae metabolite. It is an enantiomer of an ethyl (2R)-lactate.
名称と識別子
- 優先名称
- (L)-ethyl lactate
- IUPAC
- ethyl (2S)-2-hydroxypropanoate
名称と別名
名称をさらに表示
データベース識別子
- CAS
687-47-8- PubChem CID
- 92831
- DTXSID
DTXSID9042336- ChEMBL
CHEMBL3560966- ChEBI
CHEBI:78322- UNII
- GA1IKU79WZ
- EC Number
- 211-694-1
- Nikkaji
- J70.573J
物性
構造計算による物性補完中
- XLogP
- 0.2
- 極性表面積
- 46.5 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 3
- 回転可能結合数
- 3
- 重原子数
- 8
- 形式電荷
- 0
- 複雑度
- 79.7
実験および物理化学的性質
Physical Description
Liquid
Clear colorless liquid; [Sigma-Aldrich MSDS]
安全と法規制
GHS分類
GHS Classification
Danger
H226: Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264+P265, P271, P280, P303+P361+P353, P304+P340, P305+P354+P338, P317, P319, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264+P265, P271, P280, P303+P361+P353, P304+P340, P305+P354+P338, P317, P319, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
危険有害性情報
Regulatory Information
Propanoic acid, 2-hydroxy-, ethyl ester, (2S)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propanoic acid, 2-hydroxy-, ethyl ester, (2S)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 02-12-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/13866
(S)-(-)-Ethyl lactate: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and Categories
Flam. Liq. 3 (100%)
Flammable liquid - category 3
Flam. Liq. 3
毒性情報
化学と産業
用途と製造
Uses
Used to formulate plant protection products, biocidal products, washing-cleaning products, polishes-waxes, air care products, laboratory chemicals, functional fluids (lubricants, greases, heat transfer fluids, and metal working fluids), paints-coatings-printing inks, textile and leather finishing products, antifreeze and de-icing products, fillers-putties-plasters, adhesives-sealants, paper-board processing products (dyes, finishing, impregnation), fuels, adsorbents, processing aids (i.e. pH regulators, flocculants, and precipitants), pharmaceuticals, polymers, water softeners and treatment chemicals, surface treatment products for the electronics industry, metal surface treatment products (including those for galvanizing and electroplating), non-metal surface treatment products, perfumes-fragrances, and cosmetics-personal care products; [ExPub: ECHA REACH Registrations] Permitted for use as an inert ingredient in non-food pesticide products; [EPA]
Metal Machining [Category: Heat or Machine]
General Manufacturing Information
Computer and Electronic Product Manufacturing
Propanoic acid, 2-hydroxy-, ethyl ester, (2S)-: ACTIVE
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関連反応
化合物ノート
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