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39620-04-7

39620-04-7

2-Amino-3-chloropyridine

Synonyms
  • 2-Amino-3-chloropyridine
  • 39620-04-7
  • 3-chloropyridin-2-amine
  • 3-chloro-pyridin-2-ylamine
  • 2-Amino-3-chloro pyridine
Molecular Formula
C5H5ClN2

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Molecular Formula
C5H5ClN2
Iupac Name
3-chloropyridin-2-amine
Canonical Smiles
C1=CC(=C(N=C1)N)Cl
StdInChi
InChI=1S/C5H5ClN2/c6-4-2-1-3-8-5(4)7/h1-3H,(H2,7,8)
StdInChiKey
RZJPBQGRCNJYBU-UHFFFAOYSA-N
Appearance
Off-White Powder
Molecular Weight
128.56
Exact Mass
128.0141259
Average Mass
128.560 Da
Monoisotopic Mass
128.0141259
Boiling Point
207.0±20.0 °C at 760 mmHg
Experimental Boiling Point
311.5 °C
Experimental Melting Point
59-62 °C
Flash Point
79.0±21.8 °C
Density
1.3±0.1 g/cm3
Vapour Pressure
0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization
44.3±3.0 kJ/mol
Refractive Index
1.607
Molar Refractivity
33.5±0.3 cm3
Polar Surface Area
38.9 Ų
Polarizability
13.3±0.5 10-24cm3
Surface Tension
54.4±3.0 dyne/cm
Molar Volume
96.9±3.0 cm3
Experimental Logp
0.997
Acd LogP
1.84
Acd LogD Ph55
1.31
Acd Bcf Ph55
5.75
Acd Koc Ph55
120.23
Acd LogD Ph74
1.33
Acd Bcf Ph74
6.00
Acd Koc Ph74
125.42
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
0
Heavy Atom Count
8
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently Bonded Unit Count
1
H Bond Acceptors
2
H Bond Donors
2
Freely Rotating Bonds
0
Rule of 5 Violations
0
Formal Charge
0
Complexity
76.8
Compound is Canonicalized
Yes

Related Article(s)

Pyridine as a ligandNov 5, 2023

Pyridine as a ligand

When the "N" atom's sp2 lone-pair orbital faces away from the ring structure and overlaps with an empty metal orbital, a bonding contact is formed. Pyridine serves as a ligand in this approach, and it has been utilized to create metal complexes with every transition metal.

Pyridine as a solvent in paints and varnishesOct 29, 2023

Pyridine as a solvent in paints and varnishes

Pyridine, when used as a solvent, is one of the few chemicals that can revive dry linseed oil in paints and varnishes. It is used as a denaturant in ethanol to make it undrinkable.

Pyridine as antimalarialOct 22, 2023

Pyridine as antimalarial

Malaria drug research has centred on blocking the enzyme 1-deoxy-D-xylulose-5-phosphate reductoisomerase (DXR) in the nonmevalonate isoprene biosynthesis pathway. The strong DXR inhibitor fosmidomycin was shown to be both safe and effective in treating Plasmodium falciparum malaria in clinical trials.

Pyridine as anti-antioxidant agentOct 15, 2023

Pyridine as anti-antioxidant agent

Diseases associated with oxidative stress have been demonstrated to react well to antioxidant therapy, and this treatment has been proved to be both safe and effective. Consuming antioxidant-rich meals protects against neurological and cardiovascular disease in addition to decreasing cancer risk.

Pyridine as pesticideOct 8, 2023

Pyridine as pesticide

Pesticides are effective, safe, and long-lasting because of the pyridine moiety. They are ecologically sustainable while meeting the demands and trends of pesticide development. The rapid development of pyridine-containing pesticides is one of the most visible developments in the pesticide business.