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137642-06-9 | 3-Pyridinemethanamine, α-methyl-N-phenyl-
CAS No: 137642-06-9 Catalog No: AG0013NO MDL No:MFCD04035013
Product Description
Catalog Number:
AG0013NO
Chemical Name:
3-Pyridinemethanamine, α-methyl-N-phenyl-
CAS Number:
137642-06-9
Molecular Formula:
C13H14N2
Molecular Weight:
198.2637
MDL Number:
MFCD04035013
IUPAC Name:
N-(1-pyridin-3-ylethyl)aniline
InChI:
InChI=1S/C13H14N2/c1-11(12-6-5-9-14-10-12)15-13-7-3-2-4-8-13/h2-11,15H,1H3
InChI Key:
HLOSIEUNEDTQHV-UHFFFAOYSA-N
SMILES:
CC(c1cccnc1)Nc1ccccc1
Properties
Complexity:
175
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 |
|---|---|
| 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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