Home Halogens 4-(4-bromo-1H-pyrazol-1-yl)pyrimidine

4-(4-bromo-1H-pyrazol-1-yl)pyrimidine

CAS No.:
1248031-16-4
Catalog Number:
AG01AV0C
Molecular Formula:
C7H5BrN4
Molecular Weight:
225.0454
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Product Description
Catalog Number:
AG01AV0C
Chemical Name:
4-(4-bromo-1H-pyrazol-1-yl)pyrimidine
CAS Number:
1248031-16-4
Molecular Formula:
C7H5BrN4
Molecular Weight:
225.0454
MDL Number:
MFCD14605721
IUPAC Name:
4-(4-bromopyrazol-1-yl)pyrimidine
InChI:
InChI=1S/C7H5BrN4/c8-6-3-11-12(4-6)7-1-2-9-5-10-7/h1-5H
InChI Key:
ZRLMNBQRJUGUDW-UHFFFAOYSA-N
SMILES:
Brc1cnn(c1)c1ccncn1
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.97g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.049g/mol
Monoisotopic Mass:
223.97g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties