4-(Aminomethyl)-2,6-dimethylpyridine - CAS 324571-98-4

Catalog:	BB021297
Product Name:	4-(Aminomethyl)-2,6-dimethylpyridine
CAS:	324571-98-4
Synonyms:	(2,6-dimethyl-4-pyridinyl)methanamine; (2,6-dimethylpyridin-4-yl)methanamine

Technical Data

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Computed Properties

IUPAC Name:	(2,6-dimethylpyridin-4-yl)methanamine
Description:	4-(Aminomethyl)-2,6-dimethylpyridine (CAS# 324571-98-4) is a useful research chemical.
Molecular Weight:	136.19
Molecular Formula:	C8H12N2
Canonical SMILES:	CC1=CC(=CC(=N1)C)CN
InChI:	InChI=1S/C8H12N2/c1-6-3-8(5-9)4-7(2)10-6/h3-4H,5,9H2,1-2H3
InChI Key:	UEUBEPHODYIOJJ-UHFFFAOYSA-N
LogP:	1.85740

Publication Number	Title	Priority Date
WO-2020069330-A2	Inhibitors of vap-1	20180928
EP-3856176-A2	Inhibitors of vap-1	20180928
WO-2019193342-A1	Compounds and their use as pde4 activators	20180404
EP-3774780-A1	Compounds and their use as pde4 activators	20180404
US-2021032231-A1	Compounds and Their Use as PDE4 Activators	20180404

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	93.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	136.100048391
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	136.100048391
Rotatable Bond Count:	1
Topological Polar Surface Area:	38.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4