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CAS Number: 14178-45-1
6-cyanonicotinamide

Structure

6-cyanonicotinamide
Name: 6-cyanonicotinamide
Synonyms:
General Information
Product Number: 14178451

CAS Registry Number 14178-45-1
Name:
3-​Pyridinecarboxamide, 6-​cyano-
Nicotinamide, 6-cyano- (6CI,8CI)
6-Cyanonicotinamide

 

Chemical Formula: C7H5N3O
Exact Mass: 147.04
Molecular Weight: 147.13
m/z: 147.04 (100.0%), 148.05 (7.7%), 148.04 (1.1%)

 

InChI:InChI=1S/C7H5N3O/c8-3-6-2-1-5(4-10-6)7(9)11/h1-2,4H,(H2,9,11)

InChI Key:HLSHKIBATYEGMR-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=NC=C1C(=O)N)C#N

 

Thermal Properties Value Condition Note
Melting Point 275-277 °C   (1)CAS
Melting Point 275-277 °C   (2)CAS
Melting Point 243-250 °C (decomp)   (3)IC
Melting Point 184-187 °C Solv: methanol (67-56-1) (4)CAS

Specification

98%

References
  1. (1) GB 671763 1952 CAPLUS
  2. (2) Mayurnik, Geo.; Industrial and Engineering Chemistry 1952, V44, P1630-3 CAPLUS
  3. (3) Vorbrueggen, Helmut; Synthesis 1983, (4), P316-19 CAPLUS
  4. (4) Scudi, John V.; US 2789980 1957 CAPLUS
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