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CAS Number: 25177-85-9
2,3-dihydro-1H-indene-2-carboxylic acid

Structure

2,3-dihydro-1H-indene-2-carboxylic acid
Name: 2,3-dihydro-1H-indene-2-carboxylic acid
Synonyms:
General Information
Product Number: 25177859

CAS Registry Number 25177-85-9
Name:
1H-?Indene-?2-?carboxylic acid, 2,?3-?dihydro-
2-Indancarboxylic acid (6CI,7CI,8CI)
2-Indanylcarboxylic acid
Hydrindene-2-carboxylic acid

 

Chemical Formula: C10H10O2
Exact Mass: 162.07
Molecular Weight: 162.19
m/z: 162.07 (100.0%), 163.07 (11.0%)

 

InChI:InChI=1S/C10H10O2/c11-10(12)9-5-7-3-1-2-4-8(7)6-9/h1-4,9H,5-6H2,(H,11,12)

InChI Key:XUDCMQBOWOLYCF-UHFFFAOYSA-N

Canonical SMILES:C1C(CC2=CC=CC=C21)C(=O)O

 

Thermal Properties Value Condition Note
Melting Point 183-184 °C   (2)CAS
Melting Point 183 °C Solv: benzene (71-43-2) (3)CAS
Melting Point 178-179 °C Solv: ethanol (64-17-5); water (7732-18-5) (4)CAS
Melting Point 129-130 °C Solv: ethanol (64-17-5) (5)CAS
Melting Point 128-130 °C   (6)IC
Melting Point 128 °C Solv: ethyl acetate (141-78-6); ligroine (8032-32-4) (7)CAS

Specification

98%

References
  1. (2) Lindner, J.; Monatshefte fuer Chemie 1939, V72, P216-22 CAPLUS
  2. (3) Borsche, W.; Berichte der Deutschen Chemischen Gesellschaft [Abteilung] B: Abhandlungen 1921, V54B, P102-10 CAPLUS
  3. (4) v. Braun, Julius; Berichte der Deutschen Chemischen Gesellschaft [Abteilung] B: Abhandlungen 1920, V53B, P1155-73 CAPLUS
  4. (5) Dashunin, V. M.; Probl. Poluch. Poluprod. Prom. Org. Sin., Akad. Nauk SSSR, Otd. Obshch. Tekh. Khim. 1967 1967, P206-9 CAPLUS
  5. (6) Sarges, Reinhard; Journal of Medicinal Chemistry 1988, V31(1), P230-43 CAPLUS
  6. (7) Hay, Michael P.; Journal of Medicinal Chemistry 2008, V51(21), P6853-6865 CAPLUS
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