1-甲基丁基氰基乙酸乙酯，CAS 登记号 100453-11-0，由济南圣和化工有限公司现货供应，可提供纯度 按批次COA提供(不公开发布) 的规格，下游主要用于有机化学品。支持样品与小批量试用，批量价格请联系我们获取，验收以批次 COA 为准。
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Ethyl 1-methylbutyl cyanoacetate · CAS 100453-11-0 · C12H21NO2. UNII NS00004251.
| CAS Registry Number | 100453-11-0 |
|---|---|
| PubChem CID | 45489849 |
| Molecular formula | C12H21NO2 |
| IUPAC name | ethyl 2-cyano-2-ethyl-3-methylhexanoate |
| UNII (FDA) | NS00004251 |
| Molecular Weight | 211.30 |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 7 |
| Exact Mass | 211.157228913 |
| Monoisotopic Mass | 211.157228913 |
| Topological Polar Surface Area | 50.1 |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Reported hazard statements | H315 (100%), H319 (100%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
100453-11-0; Ethyl 2-cyano-2-ethyl-3-methylhexanoate; DTXSID80670482; EC 700-063-0; RefChem:138589; DTXCID20621231; 700-063-0; Ethyl 1-methylbutyl cyanoacetate; 2-cyano-2-ethyl-3-methylhexanoic acid ethyl ester; MFCD00799271; Hexanoic acid, 2-cyano-2-ethyl-3-methyl-, ethyl ester; Ethyl2-cyano-2-ethyl-3-methylhexanoate; ethyl 2-cyano-2-ethyl-3-methyl-hexanoate; FOGOQVLUCORCHH-UHFFFAOYSA-N; AKOS015842915; AS-15463
CAS 100453-11-0; molecular formula C12H21NO2; molecular weight — g/mol.
100453-11-0, Ethyl 2-cyano-2-ethyl-3-methylhexanoate, DTXSID80670482, EC 700-063-0, RefChem:138589, DTXCID20621231.
Hazard statements reported: H315, H319.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.