3-Amino-6-chloro-4-picoline - CAS 66909-38-4

Catalog:	BB033145
Product Name:	3-Amino-6-chloro-4-picoline
CAS:	66909-38-4
Synonyms:	6-chloro-4-methyl-3-pyridinamine; 6-chloro-4-methylpyridin-3-amine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	6-chloro-4-methylpyridin-3-amine
Description:	3-Amino-6-chloro-4-picoline (CAS# 66909-38-4) is a useful research chemical for the preparation of pyrazolopyridine derivatives with anticancer and angiogenesis inhibitory activity.
Molecular Weight:	142.59
Molecular Formula:	C6H7ClN2
Canonical SMILES:	CC1=CC(=NC=C1N)Cl
InChI:	InChI=1S/C6H7ClN2/c1-4-2-6(7)9-3-5(4)8/h2-3H,8H2,1H3
InChI Key:	PLSMBLIGZJWLEJ-UHFFFAOYSA-N
Boiling Point:	309.7 °C at 760 mmHg
Density:	1.26 g/cm³
LogP:	2.20680

Publication Number	Title	Priority Date
WO-2021188938-A1	Phd inhibitor compounds, compositions, and use	20200320
WO-2020255038-A1	Combination of hepatitis b virus (hbv) vaccines and pyridopyrimidine derivatives	20190618
WO-2020239855-A1	Microbiocidal derivatives	20190529
TW-202045504-A	Pyrido-pyrimidinyl compounds and methods of use	20190218
WO-2020172093-A1	Pyrido-pyrimidinyl compounds and methods of use	20190218

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Related Functional Groups

Amines and Anilines

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501
Signal Word:	Danger

Complexity:	97.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	142.0297759
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	142.0297759
Rotatable Bond Count:	0
Topological Polar Surface Area:	38.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5