Basic information
- CAS
1093351-24-6- Standard SMILES
CCOC(=O)[C@H]1CC[C@H](N)[C@H](NC(=O)OC(C)(C)C)C1.O=C(O)C(=O)O- InChIKey
XOOSYRSTVVOEEP-PBDVDRNWSA-N- Molecular formula
- C16H28N2O8
- Average molar mass
- 376.4 g/mol
- Monoisotopic mass
- 376.18456586
Names & identifiers
- Preferred name
- (1S,3R,4S)-Ethyl 4-amino-3-((tert-butoxycarbonyl)amino)cyclohexanecarboxylate oxalate
- IUPAC
- ethyl (1S,3R,4S)-4-amino-3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexane-1-carboxylate;oxalic acid
- English name
- (1S,3R,4S)-Ethyl 4-AMino-3-((tert-butoxycarbonyl)aMino)cyclohexanecarboxylate Oxalate
- Molecular formula
- C16H28N2O8
- Molecular weight
- 376.40212
Names & synonyms
1093351-24-6(1S,3R,4S)-Ethyl 4-amino-3-((tert-butoxycarbonyl)amino)cyclohexanecarboxylate oxalateethyl (1S,3R,4S)-4-amino-3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexane-1-carboxylate;oxalic acidXOOSYRSTVVOEEP-PBDVDRNWSA-N(1S,3R,4S)-4-Amino-3-[[(1,1-dimethylethoxy)carbonyl]amino]-cyclohexanecarboxylic Acid Ethyl Ester EthanedioateEthyl (1S,3R,4S)-4-amino-3-t-butoxycarbonylaminocyclohexanecarboxylate oxalate(1S,3R,4S)-ETHYL 4-AMINO-3-((TERT-BUTOXYCARBONYL)*Gadodiamide Impurity 3 (Gadodiamide EP Impurity C)(Methylamine)ethyl(1S,3R,4S)-4-amino-3-t-butoxycarbonylaminocyclohexanecarboxylateoxalate(1S,3R,4S)-ethyl 4-amino-3-((tert- butoxycarbonyl)amino)cyclohexane-1-carboxylate oxalate(1S,3R,4S)-ethyl 4-amino-3-((tert-butoxycarbonyl)amino)cyclohexane-1-carboxylate (edoxaban mesylate intermediate)Ethyl-3-(3-amino-4-(methylamino)-N-(pyridin-2-yl)benzamido)propanoate (Intermediate of Dabigatran etexilate mesylate)
Show more names
(1S,3R,4S)-ethyl 4-amino-3-((tert- butoxycarbonyl)amino)cyclohexane-1-carboxylate oxalate (Intermediate of Edoxaban mesylate)
Properties
Computed structural properties
- Topological polar surface area
- 165 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 423
Chemistry & industry
Applications
Uses(1S,3R,4S)-Ethyl 4-Amino-3-((tert-butoxycarbonyl)amino)cyclohexanecarboxylate Oxalate has been used as a reactant for the preparation of oxadiazole compounds containing cyclohexanediamine moiety.
Suppliers17 total
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
珠海海瑞德制药有限公司7737188 13326687259 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
陕西晶和医药科技有限公司029-86062279 13324594253 · [email protected]
Chongqing jooe co., ltd+86-15223382610 · [email protected]
珠海优润医药科技有限公司0756-6811852 15876689832 · [email protected]
ZHENGZHOU JIUYI TIME NEW MATERIALS CO,.LTD+8613676922317 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
上海炎泽化工有限公司15345144255 19901447308 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
Related reactions
1 records
Compound notes
Loading…