1354351-56-6

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1354351-56-6 Structure

Identification	Back Directory
[Name] CarbaMic acid, N-[(3R)-hexahydro-1H-azepin-3-yl]-, 1,1-diMethylethyl ester
[CAS] 1354351-56-6
[Synonyms] (R)-3-Boc-amino-azepane N-[(3R)-Hexahydro-1H-azepin-3-yl]carbamic acid 1,1-dimethylethyl ester CarbaMic acid, N-[(3R)-hexahydro-1H-azepin-3-yl]-, 1,1-diMethylethyl ester
[Molecular Formula] C11H22N2O2
[MDL Number] MFCD19686115
[MOL File] 1354351-56-6.mol
[Molecular Weight] 214.3

Chemical Properties	Back Directory
[Boiling point ] 322.7±31.0 °C(Predicted)
[density ] 1.01±0.1 g/cm3(Predicted)
[storage temp. ] under inert gas (nitrogen or Argon) at 2–8 °C
[pka] 12.37±0.20(Predicted)
[InChI] InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-9-6-4-5-7-12-8-9/h9,12H,4-8H2,1-3H3,(H,13,14)/t9-/m1/s1
[InChIKey] NZEPWAXJSWYEDV-SECBINFHSA-N
[SMILES] C(OC(C)(C)C)(=O)N[C@@H]1CCCCNC1

Safety Data	Back Directory
[Symbol(GHS) ] GHS07
[Signal word ] Warning
[Hazard statements ] H302
[Precautionary statements ] P280-P305+P351+P338

Spectrum Detail	Back Directory
[Spectrum Detail] CarbaMic acid, N-[(3R)-hexahydro-1H-azepin-3-yl]-, 1,1-diMethylethyl ester(1354351-56-6)¹HNMR

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