Home Other Building Blocks 5-(Bromomethyl)-1,3-dimethyl-1H-pyrazole

5-(Bromomethyl)-1,3-dimethyl-1H-pyrazole

CAS No.:
873191-23-2
Catalog Number:
AG003A88
Molecular Formula:
C6H9BrN2
Molecular Weight:
189.0531
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Product Description
Catalog Number:
AG003A88
Chemical Name:
5-(Bromomethyl)-1,3-dimethyl-1H-pyrazole
CAS Number:
873191-23-2
Molecular Formula:
C6H9BrN2
Molecular Weight:
189.0531
MDL Number:
MFCD02681908
IUPAC Name:
5-(bromomethyl)-1,3-dimethylpyrazole
InChI:
InChI=1S/C6H9BrN2/c1-5-3-6(4-7)9(2)8-5/h3H,4H2,1-2H3
InChI Key:
RTMUJHJFHWWSOE-UHFFFAOYSA-N
SMILES:
Cn1nc(cc1CBr)C
Properties
Complexity:
97.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.995g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.056g/mol
Monoisotopic Mass:
187.995g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties