(-)-Menthyl (R)-1-[(R)-alpha-methylbenzyl]aziridine-2-carboxylate

Base Information

• Chemical Name: (-)-Menthyl (R)-1-[(R)-alpha-methylbenzyl]aziridine-2-carboxylate
• CAS No.: 397849-98-8
• Molecular Formula: C₂₁H₃₁NO₂
• Molecular Weight: 329.483
• European Community (EC) Number: 693-494-8
• DSSTox Substance ID: DTXSID40429438
• Nikkaji Number: J1.854.017G
• Mol file: 397849-98-8.mol

Synonyms:397849-98-8;(-)-Menthyl (R)-1-[(R)-alpha-methylbenzyl]aziridine-2-carboxylate;[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (2R)-1-[(1R)-1-phenylethyl]aziridine-2-carboxylate;ST031674;SCHEMBL10195898;DTXSID40429438;AKOS024280350;(-)-Menthyl (R)-1-[(R)- alpha -methylbenzyl]aziridine-2-carboxylate;(-)-Menthyl (R)-1-[(R)-alpha-methylbenzyl]aziridine-2-carboxylate, 98%;(2R)-1-[(R)-alpha-Methylbenzyl]aziridine-2beta-carboxylic acid (1R,3R,4S)-p-menthane-3-yl ester

Chemical Property of (-)-Menthyl (R)-1-[(R)-alpha-methylbenzyl]aziridine-2-carboxylate

Chemical Property:

• Melting Point: 75-79°C (lit.)
• PSA: 29.31000
• LogP: 4.37370
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 329.235479232
• Heavy Atom Count: 24
• Complexity: 430

Purity/Quality:

(?)-Menthyl (R)-1-[(R)-α-methylbenzyl]aziridine-2-carboxylate 98% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

Useful:

• Canonical SMILES: CC1CCC(C(C1)OC(=O)C2CN2C(C)C3=CC=CC=C3)C(C)C
• Isomeric SMILES: C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)[C@H]2CN2[C@H](C)C3=CC=CC=C3)C(C)C