Home Halogens 4-bromo-1-cyclohexyl-1H-pyrazole

4-bromo-1-cyclohexyl-1H-pyrazole

CAS No.:
141302-40-1
Catalog Number:
AG00A5UR
Molecular Formula:
C9H13BrN2
Molecular Weight:
229.1169
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Product Description
Catalog Number:
AG00A5UR
Chemical Name:
4-bromo-1-cyclohexyl-1H-pyrazole
CAS Number:
141302-40-1
Molecular Formula:
C9H13BrN2
Molecular Weight:
229.1169
MDL Number:
MFCD12824339
IUPAC Name:
4-bromo-1-cyclohexylpyrazole
InChI:
InChI=1S/C9H13BrN2/c10-8-6-11-12(7-8)9-4-2-1-3-5-9/h6-7,9H,1-5H2
InChI Key:
ATXUIOFYFBFTSE-UHFFFAOYSA-N
SMILES:
Brc1cnn(c1)C1CCCCC1
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.026g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.121g/mol
Monoisotopic Mass:
228.026g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties