Home Halogens 3-bromo-5-chloro-1H-pyrazole

3-bromo-5-chloro-1H-pyrazole

CAS No.:
1015779-45-9
Catalog Number:
AG01CA5C
Molecular Formula:
C3H2BrClN2
Molecular Weight:
181.4184
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Product Description
Catalog Number:
AG01CA5C
Chemical Name:
3-bromo-5-chloro-1H-pyrazole
CAS Number:
1015779-45-9
Molecular Formula:
C3H2BrClN2
Molecular Weight:
181.4184
MDL Number:
MFCD22395737
IUPAC Name:
3-bromo-5-chloro-1H-pyrazole
InChI:
InChI=1S/C3H2BrClN2/c4-2-1-3(5)7-6-2/h1H,(H,6,7)
InChI Key:
XSRGYFXCFOOSBM-UHFFFAOYSA-N
SMILES:
Brc1n[nH]c(c1)Cl
Properties
Complexity:
70  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.909g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.417g/mol
Monoisotopic Mass:
179.909g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties