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1188044-87-2 | 2-(6-Fluoro-1-indanyl)acetic Acid
CAS No: 1188044-87-2 Catalog No: AG003EYH MDL No:MFCD16303859
Product Description
Catalog Number:
AG003EYH
Chemical Name:
2-(6-Fluoro-1-indanyl)acetic Acid
CAS Number:
1188044-87-2
Molecular Formula:
C11H11FO2
Molecular Weight:
194.2022
MDL Number:
MFCD16303859
IUPAC Name:
2-(6-fluoro-2,3-dihydro-1H-inden-1-yl)acetic acid
InChI:
InChI=1S/C11H11FO2/c12-9-4-3-7-1-2-8(5-11(13)14)10(7)6-9/h3-4,6,8H,1-2,5H2,(H,13,14)
InChI Key:
LHUYQQXFPZPNDL-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CCc2c1cc(F)cc2
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.205g/mol
Monoisotopic Mass:
194.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Total synthesis and analgesic activity of 6-fluoroindan-1-acetic acid and its 3-oxo derivative. | Medicinal chemistry (Shariqah (United Arab Emirates)) 20090901 |
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