Home Other Building Blocks 3-Bromo-1H-indazol-5-yl trifluoromethyl ether

3-Bromo-1H-indazol-5-yl trifluoromethyl ether

CAS No.:
1346521-23-0
Catalog Number:
AG00A00Y
Molecular Formula:
C8H4BrF3N2O
Molecular Weight:
281.0294
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Product Description
Catalog Number:
AG00A00Y
Chemical Name:
3-Bromo-1H-indazol-5-yl trifluoromethyl ether
CAS Number:
1346521-23-0
Molecular Formula:
C8H4BrF3N2O
Molecular Weight:
281.0294
MDL Number:
MFCD18074536
IUPAC Name:
3-bromo-5-(trifluoromethoxy)-2H-indazole
InChI:
InChI=1S/C8H4BrF3N2O/c9-7-5-3-4(15-8(10,11)12)1-2-6(5)13-14-7/h1-3H,(H,13,14)
InChI Key:
CZYGHZQEJXZFAW-UHFFFAOYSA-N
SMILES:
Brc1n[nH]c2c1cc(cc2)OC(F)(F)F
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.946g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
281.032g/mol
Monoisotopic Mass:
279.946g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties