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Home > Bromides > 1420537-61-6
1420537-61-6 | 1H-Indole, 5-bromo-3-iodo-6-(trifluoromethyl)-
CAS No: 1420537-61-6 Catalog No: AG001HMZ MDL No:MFCD22689162
Product Description
Catalog Number:
AG001HMZ
Chemical Name:
1H-Indole, 5-bromo-3-iodo-6-(trifluoromethyl)-
CAS Number:
1420537-61-6
Molecular Formula:
C9H4BrF3IN
Molecular Weight:
389.9384
MDL Number:
MFCD22689162
IUPAC Name:
5-bromo-3-iodo-6-(trifluoromethyl)-1H-indole
InChI:
InChI=1S/C9H4BrF3IN/c10-6-1-4-7(14)3-15-8(4)2-5(6)9(11,12)13/h1-3,15H
InChI Key:
IOLMLBNUXBFHMS-UHFFFAOYSA-N
SMILES:
Brc1cc2c(I)c[nH]c2cc1C(F)(F)F
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
388.852g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
389.942g/mol
Monoisotopic Mass:
388.852g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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