Home Halogens 1H-Indazole-5-carbonitrile, 3-bromo-1-(tetrahydro-2H-pyran-2-yl)-

1H-Indazole-5-carbonitrile, 3-bromo-1-(tetrahydro-2H-pyran-2-yl)-

CAS No.:
395101-69-6
Catalog Number:
AG00I7RX
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00I7RX
Chemical Name:
1H-Indazole-5-carbonitrile, 3-bromo-1-(tetrahydro-2H-pyran-2-yl)-
CAS Number:
395101-69-6
IUPAC Name:
3-bromo-1-(oxan-2-yl)indazole-5-carbonitrile
InChI:
InChI=1S/C13H12BrN3O/c14-13-10-7-9(8-15)4-5-11(10)17(16-13)12-3-1-2-6-18-12/h4-5,7,12H,1-3,6H2
InChI Key:
IZJBRHVACFOJFY-UHFFFAOYSA-N
Properties
Complexity:
355  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.016g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.163g/mol
Monoisotopic Mass:
305.016g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties