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CAS Number: 17071-24-8
1-(3-amino-4-methylphenyl)ethanone

Structure

1-(3-amino-4-methylphenyl)ethanone
Name: 1-(3-amino-4-methylphenyl)ethanone
Synonyms:
General Information
Product Number: 17071248

CAS Registry Number: 17071-24-8

Name:

Ethanone, 1-​(3-​amino-​4-​methylphenyl)​-
Acetophenone, 3-​amino-​4-​methyl- (4CI); Acetophenone, 3'-​amino-​4'-​methyl- (6CI,​8CI); 1-​(3-​Amino-​4-​methylphenyl)​ethanone; 3-​Amino-​4-​methylacetophenone; 3'-​Amino-​4'-​methylacetophenone; NSC 380875 

Deleted CAS Registry Numbers: 38177-​99-​0

 

Chemical Formula: C9H11NO
Exact Mass: 149.08
Molecular Weight: 149.19
m/z: 149.08 (100.0%), 150.09 (9.9%)

 

InChI: InChI=1S/C9H11NO/c1-6-3-4-8(7(2)11)5-9(6)10/h3-5H,10H2,1-2H3
InChIKey: MCQYTLIHRDCHHT-UHFFFAOYSA-N
Canonical SMILES : CC1=C(C=C(C=C1)C(=O)C)N

 

Thermal Properties Value Condition Note
Melting Point 83-84 °C Solv: ligroine (8032-32-4) (3)CAS
Melting Point 83 °C   (4)CAS
Melting Point 80-81 °C   (5)CAS
Melting Point 80-81 °C   (1)CAS
Melting Point 77-79 °C   (6)CAS
Melting Point 77 °C   (7)CAS
Melting Point 69.6-70.7 °C Solv: ethanol (64-17-5) (2)CAS

Specification

98%

References
  1. (1) Montiel, Luisa E.; Helvetica Chimica Acta 2010, V93(7), P1261-1273 CAPLUS
  2. (2) Kammari, Laxminarayana; Journal of the American Chemical Society 2010, V132(33), P11431-11433 CAPLUS
  3. (3) Sacha, M. J.; Journal of the Indian Chemical Society 1956, V33, P129-30 CAPLUS
  4. (4) Rinkes, I. J.; Recueil des Travaux Chimiques des Pays-Bas et de la Belgique 1945, V64, P205-13 CAPLUS
  5. (5) Oelschlager, Herbert; Arzneimittel-Forschung 1958, V8, P532-9 CAPLUS
  6. (6) Lutz, Robert E.; Journal of Organic Chemistry 1947, V12, P617-703 CAPLUS
  7. (7) Protiva, M.; Collection of Czechoslovak Chemical Communications 1959, V24, P1360-3 CAPLUS
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