1H-Pyrazole, 1-[4-(bromomethyl)phenyl]-


Chemical Name: 1H-Pyrazole, 1-[4-(bromomethyl)phenyl]-
CAS Number: 368869-85-6
Product Number: AG00BZ02(AGN-PC-0KKXK8)
Synonyms:
MDL No:
Molecular Formula: C10H9BrN2
Molecular Weight: 237.0959

Identification/Properties


Properties
MP:
77-79 °C
BP:
315.3°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
237.1g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
235.995g/mol
Monoisotopic Mass:
235.995g/mol
Topological Polar Surface Area:
17.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
155
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
1759
Hazard Statements:
H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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