Home Halogens 4-(2-bromophenyl)-3-methyl-1H-pyrazole

4-(2-bromophenyl)-3-methyl-1H-pyrazole

CAS No.:
1368048-62-7
Catalog Number:
AG01BDBN
Molecular Formula:
C10H9BrN2
Molecular Weight:
237.0959
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Product Description
Catalog Number:
AG01BDBN
Chemical Name:
4-(2-bromophenyl)-3-methyl-1H-pyrazole
CAS Number:
1368048-62-7
Molecular Formula:
C10H9BrN2
Molecular Weight:
237.0959
MDL Number:
MFCD22034891
IUPAC Name:
4-(2-bromophenyl)-5-methyl-1H-pyrazole
InChI:
InChI=1S/C10H9BrN2/c1-7-9(6-12-13-7)8-4-2-3-5-10(8)11/h2-6H,1H3,(H,12,13)
InChI Key:
DNCUNKPRYMFNBM-UHFFFAOYSA-N
SMILES:
Brc1ccccc1c1c[nH]nc1C
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.995g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.1g/mol
Monoisotopic Mass:
235.995g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties