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Merck
CN

452734

N-(1H-Benzotriazol-1-ylphenylmethyl)-3-pyridinecarboxamide

97%

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About This Item

Empirical Formula (Hill Notation):
C19H15N5O
CAS Number:
Molecular Weight:
329.36
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352005
MDL number:
Assay:
97%
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assay

97%

reaction suitability

reaction type: C-C Bond Formation

mp

184-188 °C (lit.)

SMILES string

O=C(NC(c1ccccc1)n2nnc3ccccc23)c4cccnc4

InChI

1S/C19H15N5O/c25-19(15-9-6-12-20-13-15)21-18(14-7-2-1-3-8-14)24-17-11-5-4-10-16(17)22-23-24/h1-13,18H,(H,21,25)

InChI key

BABUDAQOHSIBJR-UHFFFAOYSA-N

Application

N-(1H-Benzotriazol-1-ylphenylmethyl)-3-pyridinecarboxamide can be used as an amidoalkylating reagent for the preparation of amidoalkylated products of aromatic and heterocyclic compounds.
Reactant for:
  • Preparation of 3-substituted pyridinium salts


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

Regulatory Information

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N-[1-(Benzotriazol-1-yl)alkyl]amides, Versatile Amidoalkylation Reagents. Part 2. Amidoalkylation of Aromatic Compounds
Katritzky AR, et al.
Synthesis, 1991(10), 868-870 (1991)



Global Trade Item Number

SKUGTIN
452734-5G04061833323502