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883531-07-5 | (5-Fluoro-1H-indol-2-yl)methanamine
CAS No: 883531-07-5 Catalog No: AG0046SP MDL No:MFCD02089400
Product Description
Catalog Number:
AG0046SP
Chemical Name:
(5-Fluoro-1H-indol-2-yl)methanamine
CAS Number:
883531-07-5
Molecular Formula:
C9H9FN2
Molecular Weight:
164.1796
MDL Number:
MFCD02089400
IUPAC Name:
(5-fluoro-1H-indol-2-yl)methanamine
InChI:
InChI=1S/C9H9FN2/c10-7-1-2-9-6(3-7)4-8(5-11)12-9/h1-4,12H,5,11H2
InChI Key:
PJOPNLWUFQKDGJ-UHFFFAOYSA-N
SMILES:
NCc1cc2c([nH]1)ccc(c2)F
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.075g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
164.183g/mol
Monoisotopic Mass:
164.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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