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111080-65-0

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111080-65-0 Structure

111080-65-0 Structure
IdentificationBack Directory
[Name]

4-(BOC-AMINOMETHYL)PYRIDINE
[CAS]

111080-65-0
[Synonyms]

N-BOC-4-AMINOMETHYLPYRIDINE
4-(BOC-AMINOMETHYL)PYRIDINE
tert-Butyl (pyridin-4-ylmethyl)
4-(Boc-aminomethyl)pyridine ,97%
tert-butyl (pyridin-4-ylmethyl)carbamate
ert-butylN-(pyridin-4-ylmethyl)carbamate
tert-butyl N-(pyridin-4-ylmethyl)carbamate
4-[(TERT-BUTOXYCARBONYLAMINO)METHYL]PYRIDINE
4-[(tert-Butoxycarbonylamino)methyl]pyridine >
(pyridin-4-ylmethyl)carbamic acid tert-butyl ester
4-[(tert-Butoxycarbonylamino)methyl]pyridine
N-(4-Pyridinylmethyl)-Carbamic Acid 1,1-Dimethylethyl Ester
Carbamic acid, N-(4-pyridinylmethyl)-, 1,1-dimethylethyl ester
Carbamic acid, (4-pyridinylmethyl)-, 1,1-dimethylethyl ester (9CI)
[Molecular Formula]

C11H16N2O2
[MDL Number]

MFCD07369734
[MOL File]

111080-65-0.mol
[Molecular Weight]

208.26
Chemical PropertiesBack Directory
[Melting point ]

80-85 °C(lit.)
[Boiling point ]

347.6±25.0 °C(Predicted)
[density ]

1.074±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

powder to crystal
[pka]

11.44±0.46(Predicted)
[color ]

White to Light yellow
[InChI]

1S/C11H16N2O2/c1-11(2,3)15-10(14)13-8-9-4-6-12-7-5-9/h4-7H,8H2,1-3H3,(H,13,14)
[InChIKey]

KXCFJDZVQLRYSI-UHFFFAOYSA-N
[SMILES]

CC(C)(C)OC(=O)NCc1ccncc1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

22-36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[HS Code ]

29333990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Triethylamine-->Lithium Aluminum Hydride-->Di-tert-butyl dicarbonate-->4-Cyanopyridine-->4-Pyridinemethaneamine-->tert-butyl azidoformate
Hazard InformationBack Directory
[Chemical Properties]

White to light brown solid
[Uses]

N-Boc-4-aminomethylpyridine is an intermediate in the synthesis of SGI-1776-d3 (S282382), and is a Boc derivative of 4-(Aminomethyl)pyridine. 4-(Aminomethyl)pyridine (A618090) is a compound that has derivatives that act as reversible inhibitors of various copper amine oxidases (CAOs).
Spectrum DetailBack Directory
[Spectrum Detail]

4-(BOC-AMINOMETHYL)PYRIDINE(111080-65-0)1HNMR
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