tert-Butyl [(2R)-1-(1,4-diazepan-1-yl)-3-methyl-1-oxobutan-2-yl]carbamate

Base Information

• Chemical Name: tert-Butyl [(2R)-1-(1,4-diazepan-1-yl)-3-methyl-1-oxobutan-2-yl]carbamate
• CAS No.: 864754-29-0
• Molecular Formula: C15H29 N3 O3
• Molecular Weight: 299.40906
• DSSTox Substance ID: DTXSID00592273
• Wikidata: Q82486305
• Mol file: 864754-29-0.mol

Synonyms:864754-29-0;tert-Butyl [(2R)-1-(1,4-diazepan-1-yl)-3-methyl-1-oxobutan-2-yl]carbamate;(R)-[1-([1,4]DIAZEPANE-1-CARBONYL)-2-METHYL-PROPYL]-CARBAMIC ACID TERT-BUTYL ESTER;TERT-BUTYL N-[(2R)-1-(1,4-DIAZEPAN-1-YL)-3-METHYL-1-OXOBUTAN-2-YL]CARBAMATE;DTXSID00592273;DB-362298

Chemical Property of tert-Butyl [(2R)-1-(1,4-diazepan-1-yl)-3-methyl-1-oxobutan-2-yl]carbamate

Chemical Property:

• PSA: 70.67000
• LogP: 2.01520
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 299.22089180
• Heavy Atom Count: 21
• Complexity: 364

Purity/Quality:

97% ^*data from raw suppliers

(R)-[1-([1,4]DIAZEPANE-1-CARBONYL)-2-METHYL-PROPYL]-CARBAMIC ACID TERT-BUTYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(C(=O)N1CCCNCC1)NC(=O)OC(C)(C)C
• Isomeric SMILES: CC(C)[C@H](C(=O)N1CCCNCC1)NC(=O)OC(C)(C)C

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