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125328-76-9 | Ethanone, 1-(5-bromo-4-chloro-3-hydroxy-1H-indol-1-yl)-
CAS No: 125328-76-9 Catalog No: AG000NIF MDL No:MFCD04972041
Product Description
Catalog Number:
AG000NIF
Chemical Name:
Ethanone, 1-(5-bromo-4-chloro-3-hydroxy-1H-indol-1-yl)-
CAS Number:
125328-76-9
Molecular Formula:
C10H7BrClNO2
Molecular Weight:
288.5251
MDL Number:
MFCD04972041
IUPAC Name:
1-(5-bromo-4-chloro-3-hydroxyindol-1-yl)ethanone
InChI:
InChI=1S/C10H7BrClNO2/c1-5(14)13-4-8(15)9-7(13)3-2-6(11)10(9)12/h2-4,15H,1H3
InChI Key:
DQYKDYVAYNNRER-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1Cl)c(O)cn2C(=O)C
EC Number:
615-872-3
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.935g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
288.525g/mol
Monoisotopic Mass:
286.935g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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