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1788054-76-1 | Ethanone, 1-(5-bromo-3-iodo-6-methyl-1H-indazol-1-yl)-
CAS No: 1788054-76-1 Catalog No: AG0026D4 MDL No:MFCD28501546
Product Description
Catalog Number:
AG0026D4
Chemical Name:
Ethanone, 1-(5-bromo-3-iodo-6-methyl-1H-indazol-1-yl)-
CAS Number:
1788054-76-1
Molecular Formula:
C10H8BrIN2O
Molecular Weight:
378.9918
MDL Number:
MFCD28501546
IUPAC Name:
1-(5-bromo-3-iodo-6-methylindazol-1-yl)ethanone
InChI:
InChI=1S/C10H8BrIN2O/c1-5-3-9-7(4-8(5)11)10(12)13-14(9)6(2)15/h3-4H,1-2H3
InChI Key:
RTXUZXSYXZBJRF-UHFFFAOYSA-N
SMILES:
Brc1cc2c(I)nn(c2cc1C)C(=O)C
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.886g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
378.995g/mol
Monoisotopic Mass:
377.886g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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