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CAS Number: 17253-11-1
2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetic acid

Structure

2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetic acid
Name: 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetic acid
Synonyms:
General Information
Product Number: 17253111

CAS Registry Number 17253-11-1
Name:
1,​4-​Benzodioxin-​6-​acetic acid, 2,​3-​dihydro-
1,4-Benzodioxan-6-acetic acid (6CI,8CI)
(2,3-Dihydrobenzo[1,4]dioxin-6-yl)acetic acid
(Benzodioxan-6-yl)acetic acid
2-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)acetic acid

 

Chemical Formula: C10H10O4
Exact Mass: 194.06
Molecular Weight: 194.18
m/z: 194.06 (100.0%), 195.06 (11.1%), 196.06 (1.3%)

 

InChI:InChI=1S/C10H10O4/c11-10(12)6-7-1-2-8-9(5-7)14-4-3-13-8/h1-2,5H,3-4,6H2,(H,11,12)

InChI Key:BVRNERFWPQRVJB-UHFFFAOYSA-N

Canonical SMILES:C1COC2=C(O1)C=CC(=C2)CC(=O)O

 

Thermal Properties Value Condition Note
Melting Point 103-105 °C Solv: hexane (110-54-3); ethyl acetate (141-78-6) (2)CAS
Melting Point 76 °C   (4)CAS

Specification

98%

References
  1. (2) Harrak, Y.; Bioorganic & Medicinal Chemistry 2007, V15(14), P4876-4890 CAPLUS
  2. (4) Furdik, Mikulas; Acta Facultatis Rerum Naturalium Universitatis Comenianae, Chimia 1966, VNo. 11, P47-57 CAPLUS
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