226070-69-5

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226070-69-5 Structure

Identification	Back Directory
[Name] (3-HYDROXYMETHYL-BENZYL)-CARBAMIC ACID TERT-BUTYL ESTER
[CAS] 226070-69-5
[Synonyms] N-Boc-3-(aminomethyl)benzyl Alcohol tert-Butyl 3-(hydroxyMethyl)benzylcarbaMate [3-[(tert-Butoxycarbonyl)methyl]phenyl]methanol (3-HYDROXYMETHYL-BENZYL)-CARBAMIC ACID TERT-BUTYL ESTER tert-butyl N-{[3-(hydroxyMethyl)phenyl]Methyl}carbaMate N-[[3-(hydroxymethyl)phenyl]methyl]carbamic acid tert-butyl ester Carbamic acid, N-[[3-(hydroxymethyl)phenyl]methyl]-, 1,1-dimethylethyl ester
[Molecular Formula] C13H19NO3
[MDL Number] MFCD06411554
[MOL File] 226070-69-5.mol
[Molecular Weight] 237.29

Chemical Properties	Back Directory
[Melting point ] 51 °C
[Boiling point ] 0°C
[density ] 1.106±0.06 g/cm3(Predicted)
[Fp ] 0°C
[storage temp. ] 2-8°C
[pka] 12.16±0.46(Predicted)
[InChI] InChI=1S/C13H19NO3/c1-13(2,3)17-12(16)14-8-10-5-4-6-11(7-10)9-15/h4-7,15H,8-9H2,1-3H3,(H,14,16)
[InChIKey] QNDFFICIIGQGDV-UHFFFAOYSA-N
[SMILES] C(OC(C)(C)C)(=O)NCC1=CC=CC(CO)=C1
[CAS DataBase Reference] 226070-69-5

Safety Data	Back Directory
[Symbol(GHS) ] GHS07
[Signal word ] Warning
[Hazard statements ] H302
[Precautionary statements ] P280-P305+P351+P338
[Hazard Codes ] Xn
[Risk Statements ] 20/22-36/37/38-22
[Safety Statements ] 22-26-36/37/39

Spectrum Detail	Back Directory
[Spectrum Detail] (3-HYDROXYMETHYL-BENZYL)-CARBAMIC ACID TERT-BUTYL ESTER(226070-69-5)¹HNMR

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