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216584-22-4

216584-22-4 Structure

216584-22-4 Structure
IdentificationBack Directory
[Name]

N,Nμ,Nμμ-Tri-Boc-guanidine
[CAS]

216584-22-4
[Synonyms]

Guanfacine Impurity 19
1,2,3-Tri-Boc-guanidine
N,N',N''-Tri-boc-guanidine
N,Nμ,Nμμ-Tri-Boc-guanidine
6-Aminomethylpyrene,hydrochloride
Benzaldehyde,4-(7-hydroxyethoxy)-
1,2,3-Tris(tert-butoxycarbonyl)guanidine
ert-butylN-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylidene]carbamate
1,2,3-Tris(tert-butoxycarbonyl)guanidine (This product is only available in Japan.)
Carbamic acid, N,N'-[[(1,1-dimethylethoxy)carbonyl]carbonimidoyl]bis-, C,C'-bis(1,1-dimethylethyl) ester
[Molecular Formula]

C16H29N3O6
[MDL Number]

MFCD11656061
[MOL File]

216584-22-4.mol
[Molecular Weight]

359.42
Chemical PropertiesBack Directory
[Melting point ]

190-196 °C
[density ]

1.10±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

powder
[pka]

5.88±0.46(Predicted)
[Appearance]

White to off-white Solid
[InChI]

1S/C16H29N3O6/c1-14(2,3)23-11(20)17-10(18-12(21)24-15(4,5)6)19-13(22)25-16(7,8)9/h1-9H3,(H2,17,18,19,20,21,22)
[InChIKey]

XZGNHTJSFCBWHG-UHFFFAOYSA-N
[SMILES]

CC(C)(C)OC(=O)N\C(NC(=O)OC(C)(C)C)=N\C(=O)OC(C)(C)C
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22
[WGK Germany ]

3
[Storage Class]

13 - Non Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Spectrum DetailBack Directory
[Spectrum Detail]

N,Nμ,Nμμ-Tri-Boc-guanidine(216584-22-4)1HNMR
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