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CAS Number: 50868-72-9
5-methoxy-2-methylaniline

Structure

5-methoxy-2-methylaniline
Name: 5-methoxy-2-methylaniline
Synonyms:
General Information
Product Number: 50868729

CAS Registry Number: 50868-72-9

Name:

Benzenamine, 5-​methoxy-​2-​methyl-
2-​Methyl-​5-​methoxyaniline; 3-​Amino-​4-​methylanisole; 3-​Methoxy-​6-​methylaniline; 5-​Methoxy-​2-​methylaniline; NSC 229308 

 

Chemical Formula: C8H11NO
Exact Mass: 137.08
Molecular Weight: 137.18
m/z: 137.08 (100.0%), 138.09 (8.8%)
Elemental Analysis: C, 70.04; H, 8.08; N, 10.21; O, 11.66

 

InChI: InChI=1S/C8H11NO/c1-6-3-4-7(10-2)5-8(6)9/h3-5H,9H2,1-2H3
InChIKey: RPJXLEZOFUNGNZ-UHFFFAOYSA-N
Canonical SMILES : CC1=C(C=C(C=C1)OC)N

 

Thermal Properties Value Condition Note
Boiling Point 253 °C   (1)CAS
Boiling Point 253 °C   (2)SRC
Boiling Point 248-249 °C   (3)CAS
Boiling Point 3-9 °C Press: 2 Torr (4)CAS
Melting Point 47 °C   (1)CAS
Melting Point 47 °C   (2)SRC

Specification

98%

References
  1. (1) Alberola, Angel; Anales de la Real Sociedad Espanola de Fisica y Quimica, Serie B: Quimica 1959, V55B, P683-92 CAPLUS
  2. (2) "PhysProp" data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
  3. (3) Lewicka, E.; Roczniki Chemii 1926, V6, P881-9 CAPLUS
  4. (4) Tsuda, Kyosuke; Chemical & Pharmaceutical Bulletin 1962, V10, P856-65 CAPLUS
  5. (5) WSS: Wolfgang Robien / University of Vienna (Spectral Data were obtained from Wiley Subscription Services, Inc. (US))
  6. (6) Neumeyer, John L.; Journal of Medicinal Chemistry 1977, V20(7), P894-8 CAPLUS
  7. (7) Keimatsu, Ichiro; Yakugaku Zasshi 1937, V57, P992-6 (in German 274-7) CAPLUS
  8. (8) Benkeser, Robert A.; Journal of the American Chemical Society 1952, V74, P3011-14 CAPLUS
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