Home Halogens 1H-Indol-3-ol, 5-bromo-6-chloro-, 3-acetate

1H-Indol-3-ol, 5-bromo-6-chloro-, 3-acetate

CAS No.:
102185-48-8
Catalog Number:
AG0006U2
Molecular Formula:
C10H7BrClNO2
Molecular Weight:
288.5251
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Product Description
Catalog Number:
AG0006U2
Chemical Name:
1H-Indol-3-ol, 5-bromo-6-chloro-, 3-acetate
CAS Number:
102185-48-8
Molecular Formula:
C10H7BrClNO2
Molecular Weight:
288.5251
MDL Number:
MFCD00055978
IUPAC Name:
(5-bromo-6-chloro-1H-indol-3-yl) acetate
InChI:
InChI=1S/C10H7BrClNO2/c1-5(14)15-10-4-13-9-3-8(12)7(11)2-6(9)10/h2-4,13H,1H3
InChI Key:
ZGNSHSQWMJVXLS-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1c[nH]c2c1cc(Br)c(c2)Cl
Properties
Complexity:
264  
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:
2  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties