Home Nitros 2-(4-broMo-5-nitro-1H-pyrazol-1-yl)ethanol

2-(4-broMo-5-nitro-1H-pyrazol-1-yl)ethanol

CAS No.:
1429309-32-9
Catalog Number:
AG00A5N2
Molecular Formula:
C5H6BrN3O3
Molecular Weight:
236.0234
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Product Description
Catalog Number:
AG00A5N2
Chemical Name:
2-(4-broMo-5-nitro-1H-pyrazol-1-yl)ethanol
CAS Number:
1429309-32-9
Molecular Formula:
C5H6BrN3O3
Molecular Weight:
236.0234
MDL Number:
MFCD22690744
IUPAC Name:
2-(4-bromo-5-nitropyrazol-1-yl)ethanol
InChI:
InChI=1S/C5H6BrN3O3/c6-4-3-7-8(1-2-10)5(4)9(11)12/h3,10H,1-2H2
InChI Key:
LOQUSLBXRGRGKO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(Br)cnn1CCO
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.959g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.025g/mol
Monoisotopic Mass:
234.959g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties