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Home > Fluorides > 123594-01-4
123594-01-4 | Isoquinoline, 8-fluoro-1,2,3,4-tetrahydro-
CAS No: 123594-01-4 Catalog No: AG000KU6 MDL No:MFCD11223555
Product Description
Catalog Number:
AG000KU6
Chemical Name:
Isoquinoline, 8-fluoro-1,2,3,4-tetrahydro-
CAS Number:
123594-01-4
Molecular Formula:
C9H10FN
Molecular Weight:
151.1808
MDL Number:
MFCD11223555
IUPAC Name:
8-fluoro-1,2,3,4-tetrahydroisoquinoline
InChI:
InChI=1S/C9H10FN/c10-9-3-1-2-7-4-5-11-6-8(7)9/h1-3,11H,4-6H2
InChI Key:
BQEDHMMZSRJZSN-UHFFFAOYSA-N
SMILES:
Fc1cccc2c1CNCC2
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.08g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.184g/mol
Monoisotopic Mass:
151.08g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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