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159803-52-8 | 9H-Fluorene-9-acetic acid, ethyl ester
CAS No: 159803-52-8 Catalog No: AG001RER MDL No:MFCD01632142
Product Description
Catalog Number:
AG001RER
Chemical Name:
9H-Fluorene-9-acetic acid, ethyl ester
CAS Number:
159803-52-8
Molecular Formula:
C17H16O2
Molecular Weight:
252.3077
MDL Number:
MFCD01632142
IUPAC Name:
ethyl 2-(9H-fluoren-9-yl)acetate
InChI:
InChI=1S/C17H16O2/c1-2-19-17(18)11-16-14-9-5-3-7-12(14)13-8-4-6-10-15(13)16/h3-10,16H,2,11H2,1H3
InChI Key:
KSSIOELMUJKEML-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC1c2ccccc2c2c1cccc2
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.115g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.313g/mol
Monoisotopic Mass:
252.115g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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