2-Amino-5-chloro-4-methyl-3-nitropyridine - CAS 148612-17-3

Name: 2-Amino-5-chloro-4-methyl-3-nitropyridine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB010324
Product Name:	2-Amino-5-chloro-4-methyl-3-nitropyridine
CAS:	148612-17-3
Synonyms:	5-chloro-4-methyl-3-nitro-2-pyridinamine; 5-chloro-4-methyl-3-nitropyridin-2-amine

Technical Data

Patents

Computed Properties

IUPAC Name:	5-chloro-4-methyl-3-nitropyridin-2-amine
Description:	2-Amino-5-chloro-4-methyl-3-nitropyridine (CAS# 148612-17-3) is a useful research chemical for organic synthesis and other chemical processes.
Molecular Weight:	187.58
Molecular Formula:	C6H6ClN3O2
Canonical SMILES:	CC1=C(C(=NC=C1Cl)N)[N+](=O)[O-]
InChI:	InChI=1S/C6H6ClN3O2/c1-3-4(7)2-9-6(8)5(3)10(11)12/h2H,1H3,(H2,8,9)
InChI Key:	LLWKTQALVZANCU-UHFFFAOYSA-N
Boiling Point:	315.5 °C at 760 mmHg
Density:	1.5 g/cm³
LogP:	2.63820

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Related Functional Groups

Amines and Anilines

[556-90-1]C3H4N2OS
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[1232060-85-3]C6H13NO2
(3R,4R)-4-Amino-3-methoxytetrahydropyran
[1006473-17-1]C13H15F2N3
[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
[1250876-38-0]C8H14N4
1-Cyclopentyl-1H-pyrazole-3,5-diamine
[17583-40-3]C8H8N2
2-(Methylamino)benzonitrile
[42150-24-3]C5H9N3
2-(4-Pyrazolyl)ethylamine

Publication Number	Title	Priority Date
US-2021122764-A1	Small Molecule Inhibitors of KRAS G12C Mutant	20191028
WO-2021086833-A1	Small molecule inhibitors of kras g12c mutant	20191028
AU-2014248663-A1	Dihydro-pyrrolopyridinone bromodomain inhibitors	20130312
EP-2970276-A1	Dihydro-pyrrolopyridinone bromodomain inhibitors	20130312
KR-20150126696-A	Dihydro-pyrrolopyridinone bromodomain inhibitors	20130312

Complexity:	184
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	187.0148541
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	187.0148541
Rotatable Bond Count:	0
Topological Polar Surface Area:	84.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9