ChemicalBook--->CAS DataBase List--->956460-96-1

956460-96-1

956460-96-1 Structure

956460-96-1 Structure
IdentificationBack Directory
[Name]

4-Piperidinecarboxylicacid,4-[[(1,1-diMethylethoxy)carbonyl]aMino]-1-(7H-pyrrolo[2,3-d]pyriMidin-4-yl)-
[CAS]

956460-96-1
[Synonyms]

EOS-61198
4-(Boc-amino)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic Acid
4-((tert-Butoxycarbonyl)amino)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylic acid
4-Piperidinecarboxylicacid,4-[[(1,1-diMethylethoxy)carbonyl]aMino]-1-(7H-pyrrolo[2,3-d]pyriMidin-4-yl)-
[Molecular Formula]

C17H23N5O4
[MDL Number]

MFCD13177874
[MOL File]

956460-96-1.mol
[Molecular Weight]

361.4
Chemical PropertiesBack Directory
[density ]

1.37±0.1 g/cm3(Predicted)
[storage temp. ]

Store at 0-8 °C
[pka]

3.62±0.20(Predicted)
[Appearance]

white solid
[InChI]

InChI=1S/C17H23N5O4/c1-16(2,3)26-15(25)21-17(14(23)24)5-8-22(9-6-17)13-11-4-7-18-12(11)19-10-20-13/h4,7,10H,5-6,8-9H2,1-3H3,(H,21,25)(H,23,24)(H,18,19,20)
[InChIKey]

BXOSYQSFTOLZST-UHFFFAOYSA-N
[SMILES]

N1(C2N=CN=C3NC=CC3=2)CCC(NC(OC(C)(C)C)=O)(C(O)=O)CC1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H317-H319
[Precautionary statements ]

P280-P305+P351+P338
[HS Code ]

2933998090
Spectrum DetailBack Directory
[Spectrum Detail]

4-Piperidinecarboxylicacid,4-[[(1,1-diMethylethoxy)carbonyl]aMino]-1-(7H-pyrrolo[2,3-d]pyriMidin-4-yl)-(956460-96-1)1HNMR
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