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CAS Number: 6836-22-2
2-(7-methoxynaphthalen-1-yl)acetic acid

Structure

2-(7-methoxynaphthalen-1-yl)acetic acid
Name: 2-(7-methoxynaphthalen-1-yl)acetic acid
Synonyms:
General Information
Product Number: 6836222

CAS Registry Number 6836-22-2
Name:
1-​Naphthaleneacetic acid, 7-​methoxy-
(7-Methoxy-1-naphthyl)acetic acid
2-(7-Methoxynaphthalen-1-yl)acetic acid
7-Methoxy-1-naphthaleneacetic acid

 

Chemical Formula: C13H12O3
Exact Mass: 216.08
Molecular Weight: 216.23
m/z: 216.08 (100.0%), 217.08 (14.3%)

 

InChI:InChI=1S/C13H12O3/c1-16-11-6-5-9-3-2-4-10(7-13(14)15)12(9)8-11/h2-6,8H,7H2,1H3,(H,14,15)

InChI Key:GJPYHKXILUFWKV-UHFFFAOYSA-N

Canonical SMILES:COC1=CC2=C(C=CC=C2CC(=O)O)C=C1

 

Thermal Properties Value Condition Note
Melting Point 155-155.5 °C   (3)CAS
Melting Point 153-154 °C   (4)IC
Melting Point 150-152 °C   (2)CAS
Melting Point 149.5-150 °C Solv: water (7732-18-5) (5)CAS
Melting Point 145-149 °C   (1)CAS

Specification

98%

References
  1. (1) Tsuda, Etsuko; Journal of Biological Chemistry 2011, V286(3), P2354-2364 CAPLUS
  2. (2) Tang, Jia-Deng; Organic Preparations and Procedures International 2009, V41(2), P164-168 CAPLUS
  3. (3) Campbell, Wm. P.; Journal of the American Chemical Society 1942, V64, P928-35 CAPLUS
  4. (4) Silverman, I. Robert; Journal of Organic Chemistry 1985, V50(26), P5550-6 CAPLUS
  5. (5) Mentzer, Charles; Compt. rend. 1952, V234, P1692-4 CAPLUS
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