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Home > Bromides > 1000341-30-9
1000341-30-9 | 1H-Indazole, 4-bromo-3-iodo-6-(trifluoromethyl)-
CAS No: 1000341-30-9 Catalog No: AG0000GX MDL No:MFCD09263231
Product Description
Catalog Number:
AG0000GX
Chemical Name:
1H-Indazole, 4-bromo-3-iodo-6-(trifluoromethyl)-
CAS Number:
1000341-30-9
Molecular Formula:
C8H3BrF3IN2
Molecular Weight:
390.9265
MDL Number:
MFCD09263231
IUPAC Name:
4-bromo-3-iodo-6-(trifluoromethyl)-2H-indazole
InChI:
InChI=1S/C8H3BrF3IN2/c9-4-1-3(8(10,11)12)2-5-6(4)7(13)15-14-5/h1-2H,(H,14,15)
InChI Key:
IGOIJJKIDMAMMX-UHFFFAOYSA-N
SMILES:
Brc1cc(cc2c1c(I)n[nH]2)C(F)(F)F
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
389.848g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
390.93g/mol
Monoisotopic Mass:
389.848g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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