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Home > Bromides > 1385821-29-3
1385821-29-3 | 1H-Indazole, 5-bromo-4-(trifluoromethyl)-
CAS No: 1385821-29-3 Catalog No: AG0018SI MDL No:
Product Description
Catalog Number:
AG0018SI
Chemical Name:
1H-Indazole, 5-bromo-4-(trifluoromethyl)-
CAS Number:
1385821-29-3
Molecular Formula:
C8H4BrF3N2
Molecular Weight:
265.0300
IUPAC Name:
5-bromo-4-(trifluoromethyl)-1H-indazole
InChI:
InChI=1S/C8H4BrF3N2/c9-5-1-2-6-4(3-13-14-6)7(5)8(10,11)12/h1-3H,(H,13,14)
InChI Key:
FECZIZNDPJXBMQ-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1C(F)(F)F)cn[nH]2
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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