200,000+ products from a single source!
sales@angenechem.com
Home > Bromides > 1269290-97-2
1269290-97-2 | 1H-Pyrazole-4-carbonitrile, 5-bromo-1-(2-pyridinyl)-
CAS No: 1269290-97-2 Catalog No: AG000THD MDL No:MFCD17168531
Product Description
Catalog Number:
AG000THD
Chemical Name:
1H-Pyrazole-4-carbonitrile, 5-bromo-1-(2-pyridinyl)-
CAS Number:
1269290-97-2
Molecular Formula:
C9H5BrN4
Molecular Weight:
249.0668
MDL Number:
MFCD17168531
IUPAC Name:
5-bromo-1-pyridin-2-ylpyrazole-4-carbonitrile
InChI:
InChI=1S/C9H5BrN4/c10-9-7(5-11)6-13-14(9)8-3-1-2-4-12-8/h1-4,6H
InChI Key:
BPRHXCKCJNPVAT-UHFFFAOYSA-N
SMILES:
N#Cc1cnn(c1Br)c1ccccn1
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.97g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.071g/mol
Monoisotopic Mass:
247.97g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.