Home Other Building Blocks 4-BROMO-5-PROPYL-1H-PYRAZOLE

4-BROMO-5-PROPYL-1H-PYRAZOLE

CAS No.:
60061-61-2
Catalog Number:
AG01DQLB
Molecular Formula:
C6H9BrN2
Molecular Weight:
189.0531
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Product Description
Catalog Number:
AG01DQLB
Chemical Name:
4-BROMO-5-PROPYL-1H-PYRAZOLE
CAS Number:
60061-61-2
Molecular Formula:
C6H9BrN2
Molecular Weight:
189.0531
MDL Number:
MFCD26638671
IUPAC Name:
4-bromo-5-propyl-1H-pyrazole
InChI:
InChI=1S/C6H9BrN2/c1-2-3-6-5(7)4-8-9-6/h4H,2-3H2,1H3,(H,8,9)
InChI Key:
UQFOOCAHEGPJMP-UHFFFAOYSA-N
SMILES:
CCCc1c(Br)cn[nH]1
Properties
Complexity:
87.1  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
189.056g/mol
Monoisotopic Mass:
187.995g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties