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82261-42-5 | 4-Pyridin-3-ylaniline
CAS No: 82261-42-5 Catalog No: AG0055ZI MDL No:MFCD00956763
Product Description
Catalog Number:
AG0055ZI
Chemical Name:
4-Pyridin-3-ylaniline
CAS Number:
82261-42-5
Molecular Formula:
C11H10N2
Molecular Weight:
170.2105
MDL Number:
MFCD00956763
IUPAC Name:
4-pyridin-3-ylaniline
InChI:
InChI=1S/C11H10N2/c12-11-5-3-9(4-6-11)10-2-1-7-13-8-10/h1-8H,12H2
InChI Key:
DKFDPLVNPGJNDE-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1cccnc1
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.215g/mol
Monoisotopic Mass:
170.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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