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127168-78-9 | 4-Fluoroisoindoline
CAS No: 127168-78-9 Catalog No: AG000WQD MDL No:MFCD09027772
Product Description
Catalog Number:
AG000WQD
Chemical Name:
4-Fluoroisoindoline
CAS Number:
127168-78-9
Molecular Formula:
C8H8FN
Molecular Weight:
137.1542
MDL Number:
MFCD09027772
IUPAC Name:
4-fluoro-2,3-dihydro-1H-isoindole
InChI:
InChI=1S/C8H8FN/c9-8-3-1-2-6-4-10-5-7(6)8/h1-3,10H,4-5H2
InChI Key:
UDBMWFNXDSVYBR-UHFFFAOYSA-N
SMILES:
Fc1cccc2c1CNC2
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.064g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
137.157g/mol
Monoisotopic Mass:
137.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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