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39620-04-7 | 2-Amino-3-chloropyridine
CAS No: 39620-04-7 Catalog No: AG003GDH MDL No:MFCD03541052
Product Description
Catalog Number:
AG003GDH
Chemical Name:
2-Amino-3-chloropyridine
CAS Number:
39620-04-7
Molecular Formula:
C5H5ClN2
Molecular Weight:
128.5596
MDL Number:
MFCD03541052
IUPAC Name:
3-chloropyridin-2-amine
InChI:
InChI=1S/C5H5ClN2/c6-4-2-1-3-8-5(4)7/h1-3H,(H2,7,8)
InChI Key:
RZJPBQGRCNJYBU-UHFFFAOYSA-N
SMILES:
Clc1cccnc1N
Properties
Complexity:
76.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.014g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
128.559g/mol
Monoisotopic Mass:
128.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| 3-Bromo-pyridin-2-amine. | Acta crystallographica. Section E, Structure reports online 20120201 |
| 3-Chloro-pyridin-2-amine. | Acta crystallographica. Section E, Structure reports online 20110501 |
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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