2-(Aminomethyl)-4,6-dimethylpyrimidine - CAS 446829-97-6

Catalog:	BB025692
Product Name:	2-(Aminomethyl)-4,6-dimethylpyrimidine
CAS:	446829-97-6
Synonyms:	(4,6-dimethyl-2-pyrimidinyl)methanamine; (4,6-dimethylpyrimidin-2-yl)methanamine

Technical Data

Patents

Computed Properties

IUPAC Name:	(4,6-dimethylpyrimidin-2-yl)methanamine
Description:	2-(Aminomethyl)-4,6-dimethylpyrimidine (CAS# 446829-97-6 ) is a useful research chemical.
Molecular Weight:	137.18
Molecular Formula:	C7H11N3
Canonical SMILES:	CC1=CC(=NC(=N1)CN)C
InChI:	InChI=1S/C7H11N3/c1-5-3-6(2)10-7(4-8)9-5/h3H,4,8H2,1-2H3
InChI Key:	JBZOSEGGQJXUQN-UHFFFAOYSA-N
Boiling Point:	221.6 °C at 760 mmHg
Density:	1.068 g/cm³
LogP:	1.25240

Publication Number	Title	Priority Date
US-2020055824-A1	Wdr5-mll1 inhibitors and modulators	20180816
US-10807959-B2	WDR5-MLL1 inhibitors and modulators	20180816
EP-2567958-A1	Substituted 2-(chroman-6-yloxy)-thiazoles and their use as pharmaceuticals	20110912
EP-2567958-B1	Substituted 2-(chroman-6-yloxy)-thiazoles and their use as pharmaceuticals	20110912
EP-2755970-B1	Substituted 2-(chroman-6-yloxy)-thiazoles and their use as pharmaceuticals	20110912

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Complexity:	95
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	137.095297364
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	137.095297364
Rotatable Bond Count:	1
Topological Polar Surface Area:	51.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.1