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122481-11-2 | 1H-Pyrazol-1-amine, 4-bromo-
CAS No: 122481-11-2 Catalog No: AG0017AU MDL No:MFCD16620056
Product Description
Catalog Number:
AG0017AU
Chemical Name:
1H-Pyrazol-1-amine, 4-bromo-
CAS Number:
122481-11-2
Molecular Formula:
C3H4BrN3
Molecular Weight:
161.9880
MDL Number:
MFCD16620056
IUPAC Name:
4-bromopyrazol-1-amine
InChI:
InChI=1S/C3H4BrN3/c4-3-1-6-7(5)2-3/h1-2H,5H2
InChI Key:
CUULXGYOJOXCHA-UHFFFAOYSA-N
SMILES:
Nn1cc(cn1)Br
Properties
Complexity:
67.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.959g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.99g/mol
Monoisotopic Mass:
160.959g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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