Home Halogens 1-(2-bromoethyl)-4-nitro-1H-pyrazole hydrobromide

1-(2-bromoethyl)-4-nitro-1H-pyrazole hydrobromide

CAS No.:
1354954-24-7
Catalog Number:
AG019QUG
Molecular Formula:
C5H7Br2N3O2
Molecular Weight:
300.9360
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Product Description
Catalog Number:
AG019QUG
Chemical Name:
1-(2-bromoethyl)-4-nitro-1H-pyrazole hydrobromide
CAS Number:
1354954-24-7
Molecular Formula:
C5H7Br2N3O2
Molecular Weight:
300.9360
MDL Number:
MFCD20441602
IUPAC Name:
1-(2-bromoethyl)-4-nitropyrazole;hydrobromide
InChI:
InChI=1S/C5H6BrN3O2.BrH/c6-1-2-8-4-5(3-7-8)9(10)11;/h3-4H,1-2H2;1H
InChI Key:
ATLNFTFOUFWQPY-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cn(nc1)CCBr.Br
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.888g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
300.938g/mol
Monoisotopic Mass:
298.891g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties