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CAS Number: 100306-70-5
N-benzyl-3-nitropyridin-4-amine

Structure

N-benzyl-3-nitropyridin-4-amine
Name: N-benzyl-3-nitropyridin-4-amine
Synonyms:
General Information
Product Number: 100306705

CAS Registry Number 100306-70-5
Name:
4-​Pyridinamine, 3-​nitro-​N-​(phenylmethyl)​-
4-(Benzylamino)-3-nitropyridine

 

Chemical Formula: C12H11N3O2
Exact Mass: 229.09
Molecular Weight: 229.23
m/z: 229.09 (100.0%), 230.09 (13.2%), 231.09 (1.4%), 230.08 (1.1%)

 

InChI:InChI=1S/C12H11N3O2/c16-15(17)12-9-13-7-6-11(12)14-8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H,13,14)

InChI Key:MEVVLVNFFGTNKY-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C(C=C1)CNC2=C(C=NC=C2)[N+](=O)[O-]

 

Thermal Properties Value Condition Note
Melting Point 99-100 °C Solv: isopropanol (67-63-0); isopropyl ether (108-20-3) (1)CAS

Specification

98%

References
  1. (1) Singer, Robert A.; Organic Process Research & Development 2008, V12(6), P1261-1264 CAPLUS
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