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Home > Bromides > 1100212-66-5
1100212-66-5 | 7-Bromo-5-(trifluoromethyl)-1H-indazole
CAS No: 1100212-66-5 Catalog No: AG0039CE MDL No:MFCD27939136
Product Description
Catalog Number:
AG0039CE
Chemical Name:
7-Bromo-5-(trifluoromethyl)-1H-indazole
CAS Number:
1100212-66-5
Molecular Formula:
C8H4BrF3N2
Molecular Weight:
265.0300
MDL Number:
MFCD27939136
IUPAC Name:
7-bromo-5-(trifluoromethyl)-1H-indazole
InChI:
InChI=1S/C8H4BrF3N2/c9-6-2-5(8(10,11)12)1-4-3-13-14-7(4)6/h1-3H,(H,13,14)
InChI Key:
KRAPGTPHSWVOAC-UHFFFAOYSA-N
SMILES:
Brc1cc(cc2c1[nH]nc2)C(F)(F)F
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.951g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.033g/mol
Monoisotopic Mass:
263.951g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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