Ethyl 2-isocyanato-3-phenylpropionate (CAS 87543-80-4) — formula C12H13NO3, molecular weight 219.24; category organic chemicals.
| CAS Number | 87543-80-4 |
|---|---|
| Molecular Formula | C12H13NO3 |
| Molecular Weight | 219.24 |
| LogP | 3.4 |
| Category | Organic Chemicals |
Ethyl 2-isocyanato-3-phenylpropionate is a carbon-based organic compound with CAS registry number 87543-80-4 and molecular formula C12H13NO3 (molecular weight 219.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 87543-80-4
Its molecular formula C12H13NO3 comprises 12 C, 13 H, 1 N, 3 O atoms.
Also known as: Ethyl 2-isocyanato-3-phenylpropionate · 2-异氰酸基-3-苯基丙酸乙酯
Category: organic chemicals
The CAS registry number of Ethyl 2-isocyanato-3-phenylpropionate is 87543-80-4.
Molecular formula C12H13NO3, molecular weight 219.24.
It is also registered under: Ethyl 2-isocyanato-3-phenylpropionate, 2-异氰酸基-3-苯基丙酸乙酯.
Category: Organic Chemicals.
Independent reference data for Ethyl 2-isocyanato-3-phenylpropionate (CAS 87543-80-4), compiled from public chemistry databases.
| CAS Registry Number | 87543-80-4 |
|---|---|
| PubChem CID | 12370705 |
| Molecular formula | C12H13NO3 |
| IUPAC name | ethyl 2-isocyanato-3-phenylpropanoate |
| Molecular Weight | 219.24 |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 219.08954328 |
| Monoisotopic Mass | 219.08954328 |
| Topological Polar Surface Area | 55.7 |
| Heavy Atom Count | 16 |
87543-80-4; DTXSID00494804; Ethyl N-(oxomethylidene)phenylalaninate; RefChem:344932; DTXCID00445614; ETHYL 2-ISOCYANATO-3-PHENYLPROPIONATE; Ethyl 2-isocyanato-3-phenylpropanoate; ETHYL2-ISOCYANATO-3-PHENYLPROPIONATE; 2-Isocyanato-3-phenylpropionic acid ethyl ester; 2-isocyanato-3-phenyl-propionic acid ethyl ester; SCHEMBL279730; LHLIGPDDSKJRQN-UHFFFAOYSA-N; MFCD00082663; AKOS015853924; ethyl 2-isocyanato-3-phenyl-propanoate; DB-057007
| Reported hazard statements | H302 (100%), H315 (100%), H319 (100%), H332 (100%), H334 (100%), H335 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Ethyl 2-isocyanato-3-phenylpropionate · CAS 87543-80-4 · C12H13NO3.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2-异氰酸基-3-苯基丙酸乙酯