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CAS Number: 31407-25-7
2-aminoquinoline-3-carbonitrile

Structure

2-aminoquinoline-3-carbonitrile
Name: 2-aminoquinoline-3-carbonitrile
Synonyms:
General Information
Product Number: 31407257

CAS Registry Number 31407-25-7
Name:
3-?Quinolinecarbonitril?e, 2-?amino-
2-Amino-3-quinolinecarbonitrile
2-Amino-3-cyanoquinoline
NSC 108758

 

Chemical Formula: C10H7N3
Exact Mass: 169.06
Molecular Weight: 169.18
m/z: 169.06 (100.0%), 170.07 (10.9%), 170.06 (1.1%)

 

InChI:InChI=1S/C10H7N3/c11-6-8-5-7-3-1-2-4-9(7)13-10(8)12/h1-5H,(H2,12,13)

InChI Key:RANOMAHFIQOQIG-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C2C(=C1)C=C(C(=N2)N)C#N

 

Thermal Properties Value Condition Note
Melting Point 235-236 °C   (4)CAS
Melting Point 228.5-230 °C   (5)CAS
Melting Point 225-226 °C   (3)CAS
Melting Point 223 °C Solv: benzene (71-43-2) (6)CAS
Melting Point 188-192 °C Solv: tetrahydrofuran (109-99-9) (2)CAS

Specification

98%

References
  1. (2) Rane, Bhupendra S.; Journal of Fluorescence 2010, V20(1), P415-420 CAPLUS
  2. (3) El-Sayed, Ola A.; Bollettino Chimico Farmaceutico 2002, V141(6), P461-465 CAPLUS
  3. (4) Ukhin, L. Yu.; Russian Chemical Bulletin 2008, V57(2), P418-421 CAPLUS
  4. (5) Taylor, E. C., Jr.; Journal of Organic Chemistry 1953, V18, P1755-61 CAPLUS
  5. (6) Junek, H.; Monatshefte fuer Chemie 1963, V94(5), P890-6 CAPLUS
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