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Merck
CN

225967

2-Nitrobenzylamine hydrochloride

Synonym(s):

2-Nitrobenzenemethanamine hydrochloride

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About This Item

Linear Formula:
O2NC6H4CH2NH2 · HCl
CAS Number:
Molecular Weight:
188.61
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Form:
solid
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form

solid

Quality Level

mp

247 °C (dec.) (lit.)

functional group

amine, nitro

SMILES string

Cl.NCc1ccccc1[N+]([O-])=O

InChI

1S/C7H8N2O2.ClH/c8-5-6-3-1-2-4-7(6)9(10)11;/h1-4H,5,8H2;1H

InChI key

BASJTVIZZDEQBJ-UHFFFAOYSA-N

Application

2-Nitrobenzylamine hydrochloride may be used in chemical synthesis studies.
Reactant involved in synthesis of:
  • Tetrahydroisoquinolines via Heck-aza-Michael reactions
  • Aminomethylphenylamine scaffolds for factor Xa inhibition
  • Squaryliamides for mannosyltransferase inhibition
  • Fluorescent two-photon absorption benzothiadiazole dyes


pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves



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Global Trade Item Number

SKUGTIN
225967-5G04061832098876