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Home > Pyridines > 152127-34-9
152127-34-9 | N-[1-(pyridin-4-yl)ethyl]aniline
CAS No: 152127-34-9 Catalog No: AG01AXLW MDL No:MFCD04035014
Product Description
Catalog Number:
AG01AXLW
Chemical Name:
N-[1-(pyridin-4-yl)ethyl]aniline
CAS Number:
152127-34-9
Molecular Formula:
C13H14N2
Molecular Weight:
198.2637
MDL Number:
MFCD04035014
IUPAC Name:
N-(1-pyridin-4-ylethyl)aniline
InChI:
InChI=1S/C13H14N2/c1-11(12-7-9-14-10-8-12)15-13-5-3-2-4-6-13/h2-11,15H,1H3
InChI Key:
GKIQEMNPCOCAJX-UHFFFAOYSA-N
SMILES:
CC(c1ccncc1)Nc1ccccc1
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.116g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.269g/mol
Monoisotopic Mass:
198.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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