(rac)-trans-1-tert-Butyl 3-methyl 4-(1,5-naphthyridin-3-yl)pyrrolidine-1,3-dicarboxylate

Base Information

• Chemical Name: (rac)-trans-1-tert-Butyl 3-methyl 4-(1,5-naphthyridin-3-yl)pyrrolidine-1,3-dicarboxylate
• CAS No.: 1261365-91-6
• Molecular Formula: C19H23N3O4
• Molecular Weight: 357.4
• DSSTox Substance ID: DTXSID501107664
• Mol file: 1261365-91-6.mol

Synonyms:1261365-91-6;(rac)-trans-1-tert-Butyl 3-methyl 4-(1,5-naphthyridin-3-yl)pyrrolidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl (3S,4R)-4-(1,5-naphthyridin-3-yl)pyrrolidine-1,3-dicarboxylate;DTXSID501107664;MFCD18374127;1-(Tert-butyl) 3-methyl (3S,4R)-4-(1,5-naphthyridin-3-yl)pyrrolidine-1,3-dicarboxylate;1,3-Pyrrolidinedicarboxylic acid, 4-(1,5-naphthyridin-3-yl)-, 1-(1,1-dimethylethyl) 3-methyl ester, (3R,4S)-rel-;CS-0443506;(rac)-trans-1-tert-Butyl3-methyl4-(1,5-naphthyridin-3-yl)pyrrolidine-1,3-dicarboxylate;(rac)-trans-1-tert-Butyl 3-methyl 4-(1,5-naphthyridin-3-yl)pyrrolidine-1,3-dicarboxylate, AldrichCPR

Chemical Property of (rac)-trans-1-tert-Butyl 3-methyl 4-(1,5-naphthyridin-3-yl)pyrrolidine-1,3-dicarboxylate

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 357.16885622
• Heavy Atom Count: 26
• Complexity: 533

Purity/Quality:

98%min ^*data from raw suppliers

(rac)-trans-1-tert-Butyl3-methyl4-(1,5-naphthyridin-3-yl)pyrrolidine-1,3-dicarboxylate ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-36
• Safety Statements: 26

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CC(C(C1)C(=O)OC)C2=CC3=C(C=CC=N3)N=C2
• Isomeric SMILES: CC(C)(C)OC(=O)N1C[C@H]([C@@H](C1)C(=O)OC)C2=CC3=C(C=CC=N3)N=C2