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DIETHYL (BOC-AMINO)MALONATE · CAS 102831-44-7 · C12H21NO6. UNII 7V4Q8E9WWJ.
| CAS Registry Number | 102831-44-7 |
|---|---|
| PubChem CID | 382219 |
| Molecular formula | C12H21NO6 |
| IUPAC name | diethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]propanedioate |
| UNII (FDA) | 7V4Q8E9WWJ |
| Molecular Weight | 275.30 |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 9 |
| Exact Mass | 275.13688739 |
| Monoisotopic Mass | 275.13688739 |
| Topological Polar Surface Area | 90.9 |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Reported hazard statements | H315 (100%), H319 (100%), H335 (100%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Diethyl (Boc-amino)malonate; Diethyl 2-((tert-butoxycarbonyl)amino)malonate; 7V4Q8E9WWJ; UNII-7V4Q8E9WWJ; NSC 669676; NSC-669676; DTXSID30145534; DIETHYL (TERT-BUTOXYCARBONYLAMINO)MALONATE; Diethyl 2-(N-(tert-butoxycarbonyl)amino)malonate; Diethyl 2-[N-(tert-butoxycarbonyl)amino]malonate; DIETHYL 2-TERT-BUTOXYCARBONYLAMINOMALONATE; DIETHYL 2-((TERT-BUTYLOXYCARBONYL)AMINO)MALONATE; (N-TERT-BUTOXYCARBONYLAMINO)MALONIC ACID DIETHYL ESTER; PROPANEDIOIC ACID, (((1,1-DIMETHYLETHOXY)CARBONYL)AMINO)-, DIETHYL ESTER; PROPANEDIOIC ACID, 2-(((1,1-DIMETHYLETHOXY)CARBONYL)AMINO)-, 1,3-DIETHYL ESTER; RefChem:133387
CAS 102831-44-7; molecular formula C12H21NO6; molecular weight — g/mol.
Diethyl (Boc-amino)malonate, Diethyl 2-((tert-butoxycarbonyl)amino)malonate, 7V4Q8E9WWJ, UNII-7V4Q8E9WWJ, NSC 669676, NSC-669676.
Hazard statements reported: H315, H319, H335.
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.