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107045-28-3

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107045-28-3 Structure

107045-28-3 Structure
IdentificationBack Directory
[Name]

tert-butyl 4-(aMinoMethyl)benzoate
[CAS]

107045-28-3
[Synonyms]

tert-butyl 4-(aMinoMethyl)benzoate
4-(aMinoMethyl)benzoic acid tert-butyl ester
Benzoic acid, 4-(aminomethyl)-, 1,1-dimethylethyl ester
[EINECS(EC#)]

826-629-8
[Molecular Formula]

C12H17NO2
[MDL Number]

MFCD04973451
[MOL File]

107045-28-3.mol
[Molecular Weight]

207.27
Chemical PropertiesBack Directory
[Boiling point ]

311.8±25.0 °C(Predicted)
[density ]

1.052±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
[pka]

8.66±0.10(Predicted)
[InChI]

InChI=1S/C12H17NO2/c1-12(2,3)15-11(14)10-6-4-9(8-13)5-7-10/h4-7H,8,13H2,1-3H3
[InChIKey]

YCEJUWBZSJVVNE-UHFFFAOYSA-N
[SMILES]

C(OC(C)(C)C)(=O)C1=CC=C(CN)C=C1
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 InformationBack Directory
[Uses]

Tert-butyl 4-(aminomethyl)benzoate is a reactant in the preparation of benzimidazoles and analogs and their use as protein kinase inhibitors.
Spectrum DetailBack Directory
[Spectrum Detail]

tert-butyl 4-(aMinoMethyl)benzoate(107045-28-3)1HNMR
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