191663
3-Nitrobenzylamine hydrochloride
97%
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About This Item
Linear Formula:
O2NC6H4CH2NH2 · HCl
CAS Number:
Molecular Weight:
188.61
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Assay
97%
form
solid
mp
229-231 °C (lit.)
functional group
amine
nitro
SMILES string
Cl.NCc1cccc(c1)[N+]([O-])=O
InChI
1S/C7H8N2O2.ClH/c8-5-6-2-1-3-7(4-6)9(10)11;/h1-4H,5,8H2;1H
InChI key
DLZXLCHQWOZGSE-UHFFFAOYSA-N
Application
3-Nitrobenzylamine hydrochloride was used in the synthesis of an azobenzene amino acid used as photo-inducible conformational switch in polypeptides. It was also used in the synthesis of 2,4-dimethoxybenzylidene-3-nitrobenzylamine.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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X= Y-ZH Systems as Potential 1, 3-Dipoles. Part 45.1, 2Proton Sponge Effects on the 1, 2-Prototropic Formation of Azomethine Ylides from Arylidene Benzylamines.
Grigg R, et al.
Tetrahedron, 51(48), 13331-13346 (1995)
Andreas Aemissegger et al.
Nature protocols, 2(1), 161-167 (2007-04-03)
The synthesis of an azobenzene amino acid (aa) for use as a photo-inducible conformational switch in polypeptides is described. The compound can be easily incorporated into an aa sequence by solid-phase peptide synthesis using standard 9-fluorenylmethoxycarbonyl methods. A reversible conformational
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