alpha-(2-Pyridyl)benzylamine - CAS 39930-11-5

Catalog:	BB024207
Product Name:	alpha-(2-Pyridyl)benzylamine
CAS:	39930-11-5
Synonyms:	phenyl(2-pyridinyl)methanamine; phenyl(pyridin-2-yl)methanamine

Technical Data

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Computed Properties

IUPAC Name:	phenyl(pyridin-2-yl)methanamine
Description:	alpha-(2-Pyridyl)benzylamine (CAS# 39930-11-5) is a useful research chemical compound.
Molecular Weight:	184.24
Molecular Formula:	C12H12N2
Canonical SMILES:	C1=CC=C(C=C1)C(C2=CC=CC=N2)N
InChI:	InChI=1S/C12H12N2/c13-12(10-6-2-1-3-7-10)11-8-4-5-9-14-11/h1-9,12H,13H2
InChI Key:	BAEZXIOBOOEPOS-UHFFFAOYSA-N
Boiling Point:	312.2 °C at 760 mmHg
Density:	1.106 g/cm³
MDL:	MFCD00514135
LogP:	2.83000

Publication Number	Title	Priority Date
WO-2021016317-A1	Modulators of trex1	20190723
WO-2018130227-A1	Aromatic ring-containing compound, preparation method therefor, pharmaceutical composition, and use	20170116
EP-3548034-A1	Broad-spectrum inhibitors of filoviruses	20161205
US-2019292165-A1	Broad spectrum inhibitors of filoviruses	20161205
WO-2018106667-A1	Broad-spectrum inhibitors of filoviruses	20161205

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Complexity:	164
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	184.100048391
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	184.100048391
Rotatable Bond Count:	2
Topological Polar Surface Area:	38.9
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3