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177976-53-3 | 3-Pyridinemethanamine, 5-(4-fluorophenyl)-
CAS No: 177976-53-3 Catalog No: AG0025P7 MDL No:MFCD18261388
Product Description
Catalog Number:
AG0025P7
Chemical Name:
3-Pyridinemethanamine, 5-(4-fluorophenyl)-
CAS Number:
177976-53-3
Molecular Formula:
C12H11FN2
Molecular Weight:
202.2275
MDL Number:
MFCD18261388
IUPAC Name:
[5-(4-fluorophenyl)pyridin-3-yl]methanamine
InChI:
InChI=1S/C12H11FN2/c13-12-3-1-10(2-4-12)11-5-9(6-14)7-15-8-11/h1-5,7-8H,6,14H2
InChI Key:
XIINCIMTFZJTCR-UHFFFAOYSA-N
SMILES:
NCc1cncc(c1)c1ccc(cc1)F
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.091g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.232g/mol
Monoisotopic Mass:
202.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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